Introduction：Basic information about CAS 10032-13-0|hexyl isovalerate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | hexyl isovalerate |
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| CAS Number | 10032-13-0 | Molecular Weight | 186.29100 |
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| Density | 0.87g/cm3 | Boiling Point | 214.2ºC at 760mmHg |
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| Molecular Formula | C11H22O2 | Melting Point | -63.1°C (estimate) |
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| MSDS | USA | Flash Point | 82.9ºC |
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Names
| Name | hexyl isovalerate standard for gc |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 0.87g/cm3 |
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| Boiling Point | 214.2ºC at 760mmHg |
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| Melting Point | -63.1°C (estimate) |
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| Molecular Formula | C11H22O2 |
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| Molecular Weight | 186.29100 |
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| Flash Point | 82.9ºC |
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| Exact Mass | 186.16200 |
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| PSA | 26.30000 |
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| LogP | 3.15600 |
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| Vapour Pressure | 0.158mmHg at 25°C |
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| Index of Refraction | n20/D 1.419 |
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| InChIKey | RSDDTPVXLMVLQE-UHFFFAOYSA-N |
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| SMILES | CCCCCCOC(=O)CC(C)C |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- EK7908500
- CHEMICAL NAME :
- Butanoic acid, 3-methyl-, hexyl ester
- CAS REGISTRY NUMBER :
- 10032-13-0
- BEILSTEIN REFERENCE NO. :
- 1759161
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C11-H22-O2
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- >5 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 26,353,1988
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- >5 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 26,353,1988
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Safety Information
| Personal Protective Equipment | Eyeshields;Gloves;half-mask respirator (US);multi-purpose combination respirator cartridge (US) |
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| WGK Germany | 2 |
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| RTECS | EK7908500 |
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| HS Code | 2915900090 |
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Customs
| HS Code | 2915900090 |
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| Summary | 2915900090 other saturated acyclic monocarboxylic acids and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:5.5% General tariff:30.0% |
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Synonyms
| 3-methyl-butanoic acid hexyl ester |
| Isovaleriansaeure-hexylester |
| 3-methylbutyricacidhexylester |
| 1-Hexanol isovalerate |
| isovaleric acid hexyl ester |
| Hexylisovalerat |
| hexyl 3-methylbutyrate |
| HEXYLISOVALERIANAT |
| hexyl 3-methylbutanoate |
| EINECS 233-105-7 |
| MFCD00048883 |
| <n-Hexyl>-3-methyl-butyrat |
| n-Hexyl iso-valerate |
| HEXYL ISOVALERATE,NATURAL |
| n-hexylisopentanoate |
| hexyl iso-valerianate |
