Introduction:Basic information about CAS 53398-80-4|(E)-2-hexen-1-yl propionate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | (E)-2-hexen-1-yl propionate |
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| CAS Number | 53398-80-4 | Molecular Weight | 156.22200 |
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| Density | 0.896g/cm3 | Boiling Point | 195.9ºC at 760mmHg |
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| Molecular Formula | C9H16O2 | Melting Point | / |
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| MSDS | USA | Flash Point | 73.6ºC |
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Names
| Name | (2E)-hex-2-en-1-yl propanoate |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 0.896g/cm3 |
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| Boiling Point | 195.9ºC at 760mmHg |
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| Molecular Formula | C9H16O2 |
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| Molecular Weight | 156.22200 |
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| Flash Point | 73.6ºC |
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| Exact Mass | 156.11500 |
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| PSA | 26.30000 |
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| LogP | 2.29590 |
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| Index of Refraction | 1.436 |
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| InChIKey | LPWKTEHEFDVAQS-VOTSOKGWSA-N |
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| SMILES | CCCC=CCOC(=O)CC |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- MP8645000
- CHEMICAL NAME :
- 2-Hexen-1-ol, propanoate, (E)-
- CAS REGISTRY NUMBER :
- 53398-80-4
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 4
- MOLECULAR FORMULA :
- C9-H16-O2
- MOLECULAR WEIGHT :
- 156.25
- WISWESSER LINE NOTATION :
- 4U2OV2
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- Standard Draize test
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- REFERENCE :
- FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 17,807,1979 ** ACUTE 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: 17,807,1979
- 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: 17,807,1979
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Safety Information
Customs
| HS Code | 2915509000 |
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| Summary | 2915509000 propionic acid, its salts and esters。supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward)。VAT:17.0%。tax rebate rate:9.0%。MFN tariff:5.5%。general tariff:30.0% |
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Synonyms
| trans-2-Hexen-1-yl Propionate |
| propionic acid trans-2-hexen-1-yl ester |
| hex-2-enyl propanoate |