Adipic acid structure
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Common Name | Adipic acid | ||
|---|---|---|---|---|
| CAS Number | 124-04-9 | Molecular Weight | 146.141 | |
| Density | 1.3±0.1 g/cm3 | Boiling Point | 338.5±15.0 °C at 760 mmHg | |
| Molecular Formula | C6H10O4 | Melting Point | 151-154 °C(lit.) | |
| MSDS | Chinese USA | Flash Point | 196 ºC | |
| Symbol |
GHS07 |
Signal Word | Warning | |
Use of Adipic acidAdipic acid is found to be associated with HMG-CoA lyase deficiency, carnitine-acylcarnitine translocase deficiency, malonyl-Coa decarboxylase deficiency, and medium Chain acyl-CoA dehydrogenase deficiency, which are inborn errors of metabolism. |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | Adipic acid |
|---|---|
| Synonym | More Synonyms |
This table contains bioactivity, target information and biological‑assay experimental data of this compound.
| Description | Adipic acid is found to be associated with HMG-CoA lyase deficiency, carnitine-acylcarnitine translocase deficiency, malonyl-Coa decarboxylase deficiency, and medium Chain acyl-CoA dehydrogenase deficiency, which are inborn errors of metabolism. |
|---|---|
| Related Catalog | |
| Target |
Human Endogenous Metabolite |
| References |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.3±0.1 g/cm3 |
|---|---|
| Boiling Point | 338.5±15.0 °C at 760 mmHg |
| Melting Point | 151-154 °C(lit.) |
| Molecular Formula | C6H10O4 |
| Molecular Weight | 146.141 |
| Flash Point | 196 ºC |
| Exact Mass | 146.057907 |
| PSA | 74.60000 |
| LogP | 0.08 |
| Vapour density | 5 (vs air) |
| Vapour Pressure | 0.0±1.6 mmHg at 25°C |
| Index of Refraction | 1.476 |
| InChIKey | WNLRTRBMVRJNCN-UHFFFAOYSA-N |
| SMILES | O=C(O)CCCCC(=O)O |
| Stability | Stable. Substances to be avoided include ammonia, strong oxidizing agents. |
| Water Solubility | 1.44 g/100 mL (15 ºC) |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
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This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Symbol |
GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H319 |
| Precautionary Statements | P305 + P351 + P338 |
| Personal Protective Equipment | dust mask type N95 (US);Eyeshields;Gloves |
| Hazard Codes | Xi:Irritant |
| Risk Phrases | R36 |
| Safety Phrases | S26 |
| RIDADR | UN 9077 |
| WGK Germany | 1 |
| RTECS | AU8400000 |
| Hazard Class | 9.2 |
| HS Code | 2917120001 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 10 | |
|---|---|
| DownStream 9 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2917120001 |
|---|---|
| Summary | HS: 2917120001 adipic acid Tax rebate rate:13.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) VAT:17.0% MFN tariff:6.5% General tariff:30.0% |
This table lists relevant public references with title, journal and publication metadata for this compound.
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HMDB: a knowledgebase for the human metabolome.
Nucleic Acids Res. 37(Database issue) , D603-10, (2009) The Human Metabolome Database (HMDB, http://www.hmdb.ca) is a richly annotated resource that is designed to address the broad needs of biochemists, clinical chemists, physicians, medical geneticists, ... |
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Age-related reference values for urinary organic acids in a healthy Turkish pediatric population.
Clin. Chem. 40(6) , 862-6, (1994) Organic acid concentrations were quantified by gas chromatography and the individual acids identified by mass spectrometry in urine specimens from a healthy Turkish pediatric population of ages 2 days... |
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Prediction of skeletal muscle and fat mass in patients with advanced cancer using a metabolomic approach.
J. Nutr. 142(1) , 14-21, (2012) Urine and plasma metabolites originate from endogenous metabolic pathways in different organs and exogenous sources (diet). Urine and plasma were obtained from advanced cancer patients and investigate... |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| Acifloctin |
| 1,6-Hexanedioic acid |
| Adilactetten |
| 1,4-Butanedicarboxylic acid |
| EINECS 204-673-3 |
| hexane-1,6-dicarboxylic acid |
| hexanedioic acid |
| Acinetten |
| Adipic acid |
| MFCD00004420 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What are the downstream products of Adipic acid? |
| A: Related downstream products(CAS) of Adipic acid: 105-97-5;105-02-2;1071-71-2;108-63-4;4435-50-1;3068-00-6;107-21-1;542-32-5;3375-38-0. |
| Q: How is the water solubility of Adipic acid? |
| A: Water solubility of Adipic acid: 1.44 g/100 mL (15 ºC). |
| Q: What are the uses of Adipic acid? |
| A: Main uses of Adipic acid: Adipic acid is found to be associated with HMG-CoA lyase deficiency, carnitine-acylcarnitine translocase deficiency, malonyl-Coa decarboxylase deficiency, and medium Chain acyl-CoA dehydrogenase deficiency, which are inborn errors of metabolism. |
| Q: What is the InChIKey of Adipic acid? |
| A: InChIKey of Adipic acid is WNLRTRBMVRJNCN-UHFFFAOYSA-N. |
| Q: What is the melting point of Adipic acid? |
| A: Melting point of Adipic acid is 151-154 °C(lit.). |
| Q: What is the molecular weight of Adipic acid? |
| A: Molecular weight of Adipic acid is 146.141. |
| Q: What is the English name of Adipic acid? |
| A: The English name of Adipic acid is Adipic acid. |
| Q: What is the CAS number of Adipic acid? |
| A: CAS number of Adipic acid is 124-04-9. |
| Q: What English synonyms does Adipic acid have? |
| A: English synonyms of Adipic acid: Acifloctin, 1,6-Hexanedioic acid, Adilactetten, 1,4-Butanedicarboxylic acid, EINECS 204-673-3, hexane-1,6-dicarboxylic acid, hexanedioic acid, Acinetten, Adipic acid, MFCD00004420. |
| Q: What is the polar surface area (PSA) of Adipic acid? |
| A: Polar surface area (PSA) of Adipic acid is 74.60000. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |