CAS Number503-74-2
Synonyms1,1-DIMETHYLPROPYL 3-METHYLBUTANOATE; Butanoic acid,3-methyl-,1,1-dimethylpropyl ester; Isovaleric acid; MFCD00002726; isobutanoic acid; 3-Methylbutanoic acid; iso-valeric acid; 3-Methyl-n-butyric acid; tert-Amyl isovalerate; β-methylbutyric acid; 3-methyl butyric acid; 2-Isovalerylamino-naphthalin; Isovaleriansaeure-tert-pentylester; 3-Methylbutyric Acid; EINECS 207-975-3; QV1Y1&1; tert-Pentyl alcohol,isovalerate; 3-Methylbutanoic acid,3-Methylbutyric acid; 3-methyl-butanoic acid,1,1-dimethylpropyl ester; i-butanoic acid
Molecular Formula(CH3)2CHCH2COOH
Molecular Weight102.13
Purity99%
Density1.0±0.1 g/cm3
Boiling Point175-177 °C (lit.)
Melting Point−29 °C (lit.)
Appearanceliquid
EINECS207-975-3
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 503-74-2 |
| Catalog No. | 2A-9022341 |
| Chinese Name | 异戊酸 |
| Synonyms | 1,1-DIMETHYLPROPYL 3-METHYLBUTANOATE; Butanoic acid,3-methyl-,1,1-dimethylpropyl ester; Isovaleric acid; MFCD00002726; isobutanoic acid; 3-Methylbutanoic acid; iso-valeric acid; 3-Methyl-n-butyric acid; tert-Amyl isovalerate; β-methylbutyric acid; 3-methyl butyric acid; 2-Isovalerylamino-naphthalin; Isovaleriansaeure-tert-pentylester; 3-Methylbutyric Acid; EINECS 207-975-3; QV1Y1&1; tert-Pentyl alcohol,isovalerate; 3-Methylbutanoic acid,3-Methylbutyric acid; 3-methyl-butanoic acid,1,1-dimethylpropyl ester; i-butanoic acid |
| Molecular Formula | (CH3)2CHCH2COOH |
| Molecular Weight | 102.13 |
| Purity | 99 |
| Density | 1.0±0.1 g/cm3 |
| Boiling Point | 175-177 °C (lit.) |
| Melting Point | −29 °C (lit.) |
| Appearance | liquid |
| Water Solubility | 25 g/L (20 ºC) |
| Storage Condition | Store sealed and placed in a ventilated, dry envir |
| Packaging | III |
| Application | 3-Methylbutanoic acid is a natural fatty acid that may be involved in human neonatal mortality and Jamaican vomiting disease. |
| EINECS | 207-975-3 |
| HTC | 2915600000 |
| PubChem ID | 24847909 |
| MDL Number | MFCD00002726 |
| SMILES | CC(C)CC(O)=O |
| InChI | 1S/C5H10O2/c1-4(2)3-5(6)7/h4H,3H2,1-2H3,(H,6,7) |
| InChI Key | GWYFCOCPABKNJV-UHFFFAOYSA-N |
| Beilstein/REAXYS | 1098522 |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| Hazard Symbols | 6.1 |
| MSDS | msds/22341_1_503_74_2.pdf |
| Bioactivity | 3-Methylbutanoic acid is a natural fatty acid and known to effect on neonatal death and possible Jamaican vomiting sickness in human. Related Catalog Natural Products >> Acids and Aldehydes Research Areas >> Metabolic Disease Target Human Endogenous Metabolite References [1]. Ackman RG, et al. Birthweights in the Faroe Islands: possible role of isovaleric acid. J Intern Med. 1989 Feb;225(2):73-5. Chemical & Physical Properties Density 1.0±0.1 g/cm3 Boiling Point 175.3±8.0 °C at 760 mmHg Melting Point -35 °C Molecular Formula C5H10O2 Molecular Weight 102.132 Flash Point 70.6±0.0 °C Exact Mass 102.068077 PSA 37.30000 LogP 1.13 Vapour Pressure 0.6±0.7 mmHg at 25°C Index of Refraction 1.418 InChIKey GWYFCOCPABKNJV-UHFFFAOYSA-N SMILES CC(C)CC(=O)O Water Solubility 25 g/L (20 ºC) |
| Use of | 3-Methylbutanoic acid is a natural fatty acid and known to effect on neonatal death and possible Jamaican vomiting sickness in human. Properties Articles52 Name isovaleric acid Synonym More Synonyms 3-Methylbutanoic acid Biological Activity Description 3-Methylbutanoic acid is a natural fatty acid and known to effect on neonatal death and possible Jamaican vomiting sickness in human. Related Catalog Natural Products >> Acids and Aldehydes Research Areas >> Metabolic Disease Human Endogenous Metabolite References [1]. Ackman RG, et al. Birthweights in the Faroe Islands: possible role of isovaleric acid. J Intern Med. 1989 Feb;225(2):73-5. Chemical & Physical Properties Molecular Formula C5H10O2 Exact Mass 102.068077 PSA 37.30000 Index of Refraction 1.418 InChIKey GWYFCOCPABKNJV-UHFFFAOYSA-N SMILES CC(C)CC(=O)O |
| Tax Rebate | 9.0% |
| Supervision | A. Customs clearance form for inbound goods B. Customs clearance form for outbound goods |
| Inspection | R. Imported food hygiene supervision and inspection S. Export food hygiene supervision and inspection M. Imported commodity inspection N. Exported commodity inspection |
| Transport Info | Product name: Chemical name |
| Related Products in Specialty Chemicals | ||
|---|---|---|
| 5-Nonanone | 502-56-7 | 2A-9022328 |
| Cyclopentadecanone | 502-72-7 | 2A-9022330 |
| D-Methioninol | 502-83-0 | 2A-9022331 |
| Fluoroacetonitrile | 503-20-8 | 2A-9022334 |
| Trimethylene oxide | 503-30-0 | 2A-9022336 |
| Tetramic acid | 503-83-3 | 2A-9022342 |
| 2-Thiohydantoin | 503-87-7 | 2A-9022343 |
| CROTYL BROMIDE | 4784-77-4 | 2A-9022345 |
| 2,6-Dimethyl-2,5-heptadien-4-one | 504-20-1 | 2A-9022349 |
| 3(2H)-Pyridazinone | 504-30-3 | 2A-9022352 |
| Browse all Specialty Chemicals products » | ||
Phone:
630-322-8886
630-322-8887
Email:
Office Locations:
Chicago, IL, USA
San Francisco, CA, USA
EN
SDS