Introduction：Basic information about CAS 140-27-2|(2E)-3-Phenyl-2-propen-1-yl 3-methylbutanoate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | (2E)-3-Phenyl-2-propen-1-yl 3-methylbutanoate |
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| CAS Number | 140-27-2 | Molecular Weight | 218.292 |
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| Density | 1.0±0.1 g/cm3 | Boiling Point | 323.0±21.0 °C at 760 mmHg |
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| Molecular Formula | C14H18O2 | Melting Point | / |
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| MSDS | Chinese | Flash Point | 128.3±20.4 °C |
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Names
| Name | Cinnamyl Isovalerate |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.0±0.1 g/cm3 |
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| Boiling Point | 323.0±21.0 °C at 760 mmHg |
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| Molecular Formula | C14H18O2 |
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| Molecular Weight | 218.292 |
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| Flash Point | 128.3±20.4 °C |
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| Exact Mass | 218.130676 |
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| PSA | 26.30000 |
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| LogP | 4.03 |
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| Vapour Pressure | 0.0±0.7 mmHg at 25°C |
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| Index of Refraction | 1.531 |
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| InChIKey | FOCMOGKCPPTERB-RMKNXTFCSA-N |
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| SMILES | CC(C)CC(=O)OCC=Cc1ccccc1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- EK7902515
- CHEMICAL NAME :
- Butanoic acid, 3-methyl-, 3-phenyl-2-propenyl ester
- CAS REGISTRY NUMBER :
- 140-27-2
- BEILSTEIN REFERENCE NO. :
- 3201227
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C14-H18-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 :
- FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 12,857,1974
- 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 :
- FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 12,857,1974
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Safety Information
| WGK Germany | 2 |
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| RTECS | EK7902515 |
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| HS Code | 2942000000 |
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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
| (2E)-3-Phenyl-2-propen-1-yl 3-methylbutanoate |
| cinnamyl 3-methylbutanoate |
| EINECS 205-407-9 |
| Butanoic acid, 3-methyl-, (2E)-3-phenyl-2-propen-1-yl ester |
| Isovaleric Acid Cinnamyl Ester |
| (2E)-3-Phenylprop-2-en-1-yl 3-methylbutanoate |
