CAS 3058-01-3|3-Methyladipic acid
| Common Name | 3-Methyladipic acid | ||
|---|---|---|---|
| CAS Number | 3058-01-3 | Molecular Weight | 160.16800 |
| Density | 1.197 | Boiling Point | 341ºC |
| Molecular Formula | C7H12O4 | Melting Point | 95-97ºC |
| MSDS | ChineseUSA | Flash Point | 171ºC |
| Symbol | GHS07 | Signal Word | Warning |
Names
| Name | 3-methyladipic acid |
|---|---|
| Synonym | More Synonyms |
3-Methyladipic acid BiologicalActivity
| Description | 3-Methyladipic acid is the final metabolite in the ω-oxidation pathway. |
|---|---|
| Related Catalog | Natural Products >>Acids and AldehydesResearch Areas >>Metabolic Disease |
| Target | Human Endogenous Metabolite |
| References | [1]. Wierzbicki AS, et al. Refsum's disease: a peroxisomal disorder affecting phytanic acid alpha-oxidation. J Neurochem. 2002 Mar;80(5):727-35. |
Chemical & Physical Properties
| Density | 1.197 |
|---|---|
| Boiling Point | 341ºC |
| Melting Point | 95-97ºC |
| Molecular Formula | C7H12O4 |
| Molecular Weight | 160.16800 |
| Flash Point | 171ºC |
| Exact Mass | 160.07400 |
| PSA | 74.60000 |
| LogP | 0.96200 |
| InChIKey | SYEOWUNSTUDKGM-UHFFFAOYSA-N |
| SMILES | CC(CCC(=O)O)CC(=O)O |
Safety Information
| Symbol | GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H315-H319-H335 |
| Precautionary Statements | P261-P305 + P351 + P338 |
| Personal Protective Equipment | dust mask type N95 (US);Eyeshields;Gloves |
| Hazard Codes | Xi:Irritant; |
| Risk Phrases | R36/37/38 |
| Safety Phrases | S24/25 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 3 |
| HS Code | 2917190090 |
Customs
| HS Code | 2917190090 |
|---|---|
| Summary | 2917190090 acyclic polycarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
Articles8
More Articles| 2,6-Dimethyloctanedioic acid--a metabolite of phytanic acid in Refsum's disease. Clin. Chem. 29(3) , 434-7, (1983) The urine of two patients with Refsum's disease consistently contained 2,6-dimethyloctanedioic acid, a compound not normally found in human urine. In addition, their urines contained increased concent... | |
| Metabolism of phytanic acid and 3-methyl-adipic acid excretion in patients with adult Refsum disease. J. Lipid Res. 44(8) , 1481-8, (2003) Adult Refsum disease (ARD) is associated with defective alpha-oxidation of phytanic acid (PA). omega-Oxidation of PA to 3-methyl-adipic acid (3-MAA) occurs although its clinical significance is unclea... | |
| Supramolecular helical mesomorphic polymers. Chiral induction through H-bonding. J. Am. Chem. Soc. 127(1) , 458-64, (2005) The work described here concerns a challenge of general interest in supramolecular chemistry: the achievement of chiral helical organizations with controlled structures. This work provides a strategy ... |
Synonyms
| MFCD00002804 |
| 3-methylhexane-1,6-dioic acid |
| EINECS 221-293-3 |
| 3-Methylhexanedioic acid |
| 3R-methyladipic acid |
| 3-Methyladipic acid |
| 3-methylhexanedioate |
| 3-methyl-hexanedioic acid |
