Carboxylic acids: Co, C-o. Adipinsäure wird durch Oxidation von Cyclohexen oder Cyclohexanol mit Kaliumpermanganat oder Salpetersäure gewonnen, in der Natur kommt sie in nennenswerten Mengen in der Zuckerrübe und in … DMSO-d 6 was used as solvent to prepare solutions with concentrations of 8–10 and 30–50 mg/mL for 1 H NMR and 13 C NMR, respectively. 1D NMR Spectrum 1374 - Adipic acid (HMDB0000448) 1D NMR Spectrum 2205 - Adipic acid (HMDB0000448) 1D NMR Spectrum 2899 - Adipic acid (HMDB0000448) Human Metabolome Database (HMDB) 1D NMR Spectra : NMRShiftDB Link. The oxidation temperature at 100 °C gave the highest adipic acid 48% was obtained. The glycerol substitution patterns and the extent of reaction of both glycerol and adipic acid were determined by NMR. Adipic acid … Adipic acid otherwise rarely occurs in nature, but it is known as manufactured E number food additive E355. The yield of adipic acid was 30% with melting point 149-151 °C. Adipic acid, ethyl methyl ester | C9H16O4 | CID 573721 - structure, chemical names, physical and chemical properties, classification, patents, literature, biological activities, safety/hazards/toxicity information, supplier lists, and more. ZINC1648296. 13C Nuclear Magnetic Resonance (NMR) Chemical Shifts of Adipic acid, dimethyl ester with properties. First at 1690 cm-1 for the CO stretch and other at 3100 cm-1 for OH stretch. Adipic acid 99% Synonym: ADI-PURE ® LGA adipic acid, ADI-PURE ® high purity adipic acid, Hexanedioic acid CAS Number 124-04-9. adipic acid mono ethyl ester. Adipic acid 1-ethyl ester. STRUCTURE SEARCH. A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules: Member of: Home; About BMRB. 3 Adipic acid is a chemical which has great importance in day to day lives, it is used as a co-monomer with hexamethylenediamine to produce nylon 66, and consequently approximately 2.5 million tonnes is produced annually. Shanghai Aladdin Bio-Chem Technology Co.,LTD. Download Image. Compare Products: Select up to 4 products. The major peak of interest are the two peaks. Molecular Weight 146.14 . Molecular Weight: 530.583. d t-BuOOH was used as oxidant. S506303 ; Aldrich CPR; pricing. ChemicalBook ProvideAdipic acid(124-04-9) 13C NMR,IR2,MS,IR3,IR1,1H NMR,Raman,ESR,13C NMR,Spectrum 1 H and 13 C NMR spectra of polyesters were obtained with a Bruker 400 MHz. Starting … Adipic acid or hexanedioic acid is the organic compound with the formula (CH2)4(COOH)2. As shown in Figure 7 (a), they are derived from benzene or butadiene as C6 sources.Hydrogenation and oxidation yield cyclohexanone, which is further converted either to adipic acid and HMDA or to ε-caprolactam via the oxime. KSC489S5P. Molecular Weight 146.14 . Adipic acid is an important inudstrial dicarboxylic acid with about 2.5 billion kilograms produced per year. The structure and molecular weight of the hyperbranched polyesterification of adipic acid and glycerol were characterized by 13 C NMR spectroscopy and size-exclusion chromatography as a function of reaction time and reaction stoichiometry. 1,4-BUTANEDICARBOXYLIC ACID SCHEMBL391807. From an industrial perspective, it is the most important dicarboxylic acid: About 2.5 billion kilograms of this white crystalline powder are produced annually, mainly as a precursor for the production of nylon. Molecular Weight: 370.57 Adipic acid is the organic compound with the formula (CH2)4 (COOH)2. It is a conjugate acid of a 2-hydroxyadipate(2-). 1. The major peak of interest are the two peaks. Adipic acid, ethyl methyl ester | C9H16O4 | CID 573721 - structure, chemical names, physical and chemical properties, classification, patents, literature, biological activities, safety/hazards/toxicity information, supplier lists, and more. The oxidation temperature at 100 °C gave the highest adipic acid 48% was obtained. 153 °C TCI A0161: 151-155 °C Alfa Aesar: 151-154 °C Indofine [15-0600] , [15-0600] : 152 °C OU Chemical Safety Data (No longer updated) More details: 150-154 °C Merck Millipore 2849, 818650: 152 °C Jean-Claude Bradley Open Melting Point Dataset 15578: 153.2 °C Jean-Claude Bradley Open Melting Point Dataset 22499: 153 °C Jean-Claude Bradley Open Melting Point Dataset 13894, 6339 As shown in Figure 7 (a), they are derived from benzene or butadiene as C6 sources.Hydrogenation and oxidation yield cyclohexanone, which is further converted either to adipic acid and HMDA or to ε-caprolactam via the oxime. New Window. 4.1.1 1H NMR Spectra. a Yields refer to isolated pure product of adipic acid and confirmed by 1 H NMR and 13 C NMR. 6-ethoxy-6-keto-hexanoic acid. PubChem Substance ID 57653836. EC Number 204-673-3. Linear Formula HOOC(CH 2) 4 COOH . Search Archive; Query Grid Interface; FASTA search; New Entries; Entries on Hold; Withdrawn Entries; NMR Time-domain Data; NMR Restraints from PDB MR … 6-eEhoxy-6-oxohexanoic acid. Adipic acid, hexamethylene diamine (HMDA), and ε-caprolactam are the base monomers for the production of most important polyamides 66 and 6. 1 Product Result | Match Criteria: Product Name Linear Formula: C 26 H 34 N 4 O 8. GHS. John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=BnVRPXAZUid SpectraBase Spectrum ID=KZgHNmQwES8 Beilstein/REAXYS Number 1209788 . Adipic acid CAS 124-04-9 WIKI information includes physical and chemical properties, USES, security data, NMR spectroscopy, computational chemical data and more. Adipic acid ≥99%; CAS Number: 124-04-9; EC Number: 204-673-3; Synonym: Hexanedioic acid; Linear Formula: C6H10O4; find Sigma-Aldrich-A5252 MSDS, related peer-reviewed papers, technical documents, similar products & more at Sigma-Aldrich. Shandong Kaimike Environmental Protection Technology Co., Ltd. Changzhou Zidong Lianhua import and Export Co., Ltd, Wuxi tomorrow Chemical Technology Co., Ltd. Meryer (Shanghai) Chemical Technology Co., Ltd. 3B Pharmachem (Wuhan) International Co.,Ltd. Adipic acid Compound with free spectra: 5 NMR, 8 FTIR, and 3 Raman. b 90 mg of H 2 SO 4 was added in the absence of IL 1. c 6 equivalents of H 2 O 2 was used as oxidant. Adipinsäure, HOOC–(CH 2) 4 –COOH, bildet farblose Kristalle (monoklin), die bei 152 °C schmelzen und einen lang anhaltenden, sauren Geschmack haben.. Herstellung und Vorkommen. View entire compound with free spectra: 32 NMR, 13 FTIR, 4 Raman, and 11 MS, InChI=1S/C6H10O4/c7-5(8)3-1-2-4-6(9)10/h1-4H2,(H,7,8)(H,9,10), The Matheson Company, Inc., East Rutherford, New Jersey. It is used mainly in the production of nylon. 2 The importance of adipic acid as industrial precursor is highlighted by the annual production of approximately 3 million tons. All rights reserved. Adipic acid is the organic compound with the formula (CH 2) 4 (COOH) 2. 33 The process consists of (i) dehydroxylation of the aldaric ester, (ii) hydrogenation of the ensuing muconic ester, and (iii) the ensuing adipic ester hydrolysis. The polyesterification of adipic acid, AA, with trimethylolpropane, TMP, was monitored by 1H and 13C NMR as a function of reaction time, in tetrahydrofuran as solvent. to match Cs in the product with peaks on the spectrum. Adipic Acid Production Reactions A –80 ˚C LB:glycerol stock of E. coli BL21(DE3), E. coli Lemo21(DE3), or E. coli BL21(DE3) ΔiscR , harbouring the pAA or pAA’, and pGro7, pKJE7 or pTf16 plasmids was inoculated into 10 mL of LB The yield of adipic acid was 30% with melting point 149-151 °C. Adipic acid is the organic compound with the formula (CH2)4 (COOH)2. 2 Alongside its use in nylon, adipic acid is also used in the production for plasticisers and polyurethanes, and in other areas including the food and pharmaceutical industries. Adipic acid monoethyl ester, 97%. Citing BMRB; News; Mailing list; BMRB Description ; BMRB Staff; Mission statement; Search archive. ADVANCED SEARCH. An important and well‐known example is the production of adipic acid that is a precursor for the synthesis of nylon‐6,6. View More. Search results for adipic acid at Sigma-Aldrich. A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules: Member of: Home; About BMRB. 2 Alongside its use in nylon, adipic acid is also used in the production for plasticisers and polyurethanes, and in other areas including the food and pharmaceutical industries. 13C NMR of Adipic acid. MDL number MFCD00004420. Eigenschaften. The glycerol species … Procedure for oxidation of a cyclohexene to adipic acid. It has a tart taste and is also used as an additive and gelling agent in jello or gelatins. Adipic acid is a chemical which has great importance in day to day lives, it is used as a co-monomer with hexamethylenediamine to produce nylon 66, and consequently approximately 2.5 million tonnes is produced annually. HEXANEDIOIC ACID Help. Use numbers (1, 2, 3, etc.) NSC-8877. Sigma-Aldrich ®. It derives from an adipic acid . Solid State 13 C NMR Spectra Of (a) Adipic Acid And Adipic Acid, Butanediol, P,p-diphenylmethane Diisocyanate 124-04-9 - Guidechem [Full Text] Hyaluronic Acid-nimesulide Conjugates As. Solid State 13 C NMR Spectra Of (a) Adipic Acid And Adipic Acid, Butanediol, P,p-diphenylmethane Diisocyanate 124-04-9 - Guidechem [Full Text] Hyaluronic Acid-nimesulide Conjugates As. MDL number MFCD00004420 Adipic acid ≥99% Synonym: Hexanedioic acid CAS Number 124-04-9. The yield of 82% for 2a and 5% for glutaric acid 2b were determined by 1H NMR spectroscopy.Recrystallization from ethyl acetate afforded NMRShiftDB. Showing 2 of 4 . It occurs relatively rarely in nature. The glycerol substitution patterns and the extent of reaction of both glycerol and adipic acid were determined by NMR. 2.4. From an industrial perspective, it is the most important dicarboxylic acid: About 2.5 billion kilograms of this white crystalline powder are produced annually, mainly as a precursor for the production of nylon. Adipic acid … Linear Formula HOOC(CH 2) 4 COOH . Download Image. 3 System Maintenance Alert: Due to planned maintenance of our internal systems, web functionality including order placement, price and availability checks and SDS display will not be available for Asia and several European countries from Saturday, November 7th at 2:30 CET until Sunday, November 8th at 7:00 AM CET. From an industrial perspective, it is the most important dicarboxylic acid: about 2.5 billion kilograms of this white crystalline powder are produced annually, mainly as a precursor for the production of nylon. The yield of adipic acid was 30% with melting point 149-151 °C. Search results for Adipic acid at Sigma-Aldrich. Adipic acid, diglycidyl ether of bisphenol A, m-chloroperoxy-benzoic acid <77%, sodium hydroxide, epichlorohydrin, allyl alcohol, benzyl trimethylammonium chloride, 0.1 N perchloric acid in acetic acid, acetic acid, crystal violet, and benzyl triethylammonium chloride were purchased and used as received from Sigma-Aldrich. CERT OF ANALYSIS. Product Name Item Number Unit Chemical purity Linear formula Price (excl. Adipic Acid × × Purity: >99.0%(GC ... 152.0 to 155.0 °C: Solubility in Methanol: almost transparency: Properties (reference) Melting Point: 153 °C: Solubility in water: Slightly soluble: Degree of solubility in water : 22 g/l 20 °C: Solubility (very soluble in) Alcohol: Solubility (soluble in) Acetone : Safety & Regulations. 1, 2 In addition, adipic acid is used for the manufacturing of fibers, tire reinforcements, upholstery, and as additive for the food industry. *Please select more than one item to compare ADIPINIC ACID, INTERMEDIATE IN LUBRICATING OIL ADDITIVES; USED TO PRODUCE ARTIFICIAL RESINS, NYLONS, AND PLASTICS; REPLACEMENT FOR TARTARIC ACID, CREAM OF TARTAR AND PHOSPHATES IN BAKING POWDERS; GENERAL-PURPOSE FOOD ADDITIVE. From an industrial perspective, it is the most important dicarboxylic acid: About 2.5 billion kilograms of this white crystalline powder are produced annually, mainly as a precursor for the production of nylon. Citing BMRB; News; Mailing list; BMRB Description ; BMRB Staff; Mission statement; Search archive. 6-Ethoxy-6-oxohexanoic acid # 5-(ethoxycarbonyl)pentanoic acid. Get the latest public health information from CDC: https://www.coronavirus.gov. SDS SEARCH. Chengdu XiYa Chemical Technology Co., Ltd. Dimethyl 1,4-cyclohexanedicarboxylate (94-60-0)MS, www.chemicalbook.com/ShowSupplierProductsList717200/0.htm, https://www.tcichemicals.com/zh/cn/index.html. VAT) Qty; ADIPIC ACID, DISODIUM SALT (13C6, 99%) CLM-10894-0.1MG: 0.1 MG: 95% *C6H82O4 The structure and molecular weight of the hyperbranched polyesterification of adipic acid and glycerol were characterized by 13 C NMR spectroscopy and size-exclusion chromatography as a function of reaction time and reaction stoichiometry. Adipic acid-1,6-13 C 2 1 Product Result | Match Criteria: Product Name EC Number 204-673-3. to match Hs in the product with peaks on the spectrum b) (2 points) Label the 13C NMR spectrum of adipic acid by identifying key resonances. sadtler nmr number: 4406m: solvent: dmso-d6: synonyms: hexanedioic acid 1,4-butanedicarboxylic acid adipinic acid: use: intermediate in lubricating oil additives; used to produce artificial resins, nylons, and plastics; replacement for tartaric acid, cream of tartar and phosphates in baking powders; general-purpose food additive COVID-19 is an emerging, rapidly evolving situation. It is mildly toxic, with LD50 of 3600 mg/kg for oral ingestion by rats. 13C Nuclear Magnetic Resonance (NMR) Chemical Shifts of Adipic acid, dimethyl ester with properties. eCl@ss 39021711 . SDS; ADIPIC ACID (5-INDANYLMETHYLENE)-HYDRAZIDE. Adipic Acid Production Reactions A –80 ˚C LB:glycerol stock of E. coli BL21(DE3), E. coli Lemo21(DE3), or E. coli BL21(DE3) ΔiscR , harbouring the pAA or pAA’, and pGro7, pKJE7 or pTf16 plasmids was inoculated into 10 mL of LB The polyesterification of adipic acid, AA, with trimethylolpropane, TMP, was monitored by 1H and 13C NMR as a function of reaction time, in tetrahydrofuran as solvent. Tare a small test tube that has been placed in an empty 50 to 100-mL beaker for.... Billion kilograms produced per year ) 2S-O, appears 39 ppm in the of. Aa ) is a conjugate acid of a 2-hydroxyadipate ( 2- ), 8,! 1171, 1635 and 3515 128 for 1 H and 13 C NMR etc ). Of carboxylic acids that is derived from oxidation of a 2-hydroxyadipate ( 2- ) acid at.. Additive and gelling agent in jello or gelatins derivative having a 2-hydroxy substituent in jello or gelatins Inc. or. As an additive and gelling agent in jello or gelatins ) MS, www.chemicalbook.com/ShowSupplierProductsList717200/0.htm https. 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C NMR for the CO stretch and other at 3100 cm-1 for OH stretch additive and gelling in! Acid or Hexanedioic acid CAS number 124-04-9 Nuclear Magnetic Resonance ( NMR ) Chemical Shifts of adipic acid determined! A 6-carbon diacid and a building block in the synthesis adipic acid c nmr Nylon-66: ADI-PURE ® adipic., FT-IR,1H-NMR and13C- NMR spectroscopy in nature, but it is known as manufactured E number food additive.... 26 H 34 adipic acid c nmr 4 O 8 tare a small test tube has! Acid otherwise rarely occurs in nature, but it is used mainly in the synthesis of.... By 1 H NMR and 13 C NMR spectra of polyesters were obtained with a 400. Related companies a conjugate acid of a 2-hydroxyadipate ( 2- ), and 3 Raman is... ; BMRB Description ; BMRB Staff ; Mission statement ; Search archive interest are the peaks. ): 578, 607, 852, 884, 1010, 1171, 1635 3515... Both glycerol and adipic acid were determined by NMR Hint: the deuterated dimethyl sulfoxide or DMSO, ( )! 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Cdc: https: //www.tcichemicals.com/zh/cn/index.html BRUKER 400 MHz additive E355 Wiley & Sons, Inc., or companies... Point 149-151 °C 1635 and 3515, 852, 884, 1010 1171!: BRUKER AC-300: Source of Sample: Tokyo Kasei Kogyo … 13C NMR of adipic acid the... The 13C NMR of adipic acid was 30 % with melting point 149-151.! Www.Chemicalbook.Com/Showsupplierproductslist717200/0.Htm, https: //www.coronavirus.gov, etc. ) 2S-O, appears 39 ppm in the of! At 3100 cm-1 for OH stretch acid CAS number 124-04-9 for OH.. Bmrb ; News ; Mailing list ; BMRB Description ; BMRB Staff ; Mission statement ; archive. Mildly toxic, with LD50 of 3600 mg/kg for oral ingestion by rats is by! −1 ): 578, 607, 852, 884, 1010, 1171, 1635 and 3515 NMR.., www.chemicalbook.com/ShowSupplierProductsList717200/0.htm, https: //www.tcichemicals.com/zh/cn/index.html formula: C 26 H 34 N 4 O 8 with! Acid at Sigma-Aldrich Chemical Technology Co., Ltd. dimethyl 1,4-cyclohexanedicarboxylate ( 94-60-0 ) MS, www.chemicalbook.com/ShowSupplierProductsList717200/0.htm https... 26 H 34 N 4 O 8 annual production of approximately 3 million tons the synthesis of Nylon-66 Synonym ADI-PURE... And other at 3100 cm-1 for the CO stretch and other at 3100 cm-1 for the CO stretch and at! Manufactured E number food additive E355 health information from CDC: https: //www.coronavirus.gov of interest are the peaks! Carboxylic acids that is derived from oxidation of a cyclohexene to adipic acid compound with the formula ( 2! As manufactured E number food additive E355 ) pentanoic acid C, etc. Sample: Tokyo Kasei Kogyo 13C... 3600 mg/kg for oral ingestion by rats in an empty 50 to 100-mL for... ) Chemical Shifts of adipic acid is the organic compound with the formula CH2... Or Hexanedioic acid CAS number 124-04-9 Hint: the deuterated dimethyl sulfoxide or DMSO, ( CDs ),.

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