Introduction：Basic information about CAS 103-52-6|Phenethyl butyrate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Phenethyl butyrate |
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| CAS Number | 103-52-6 | Molecular Weight | 192.254 |
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| Density | 1.0±0.1 g/cm3 | Boiling Point | 270.0±9.0 °C at 760 mmHg |
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| Molecular Formula | C12H16O2 | Melting Point | / |
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| MSDS | ChineseUSA | Flash Point | 109.9±17.1 °C |
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Names
| Name | phenethyl butyrate |
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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 | 270.0±9.0 °C at 760 mmHg |
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| Molecular Formula | C12H16O2 |
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| Molecular Weight | 192.254 |
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| Flash Point | 109.9±17.1 °C |
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| Exact Mass | 192.115036 |
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| PSA | 26.30000 |
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| LogP | 3.36 |
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| Vapour Pressure | 0.0±0.6 mmHg at 25°C |
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| Index of Refraction | 1.497 |
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| InChIKey | WFNDDSQUKATKNX-UHFFFAOYSA-N |
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| SMILES | CCCC(=O)OCCc1ccccc1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- ET5956200
- CHEMICAL NAME :
- Butyric acid, phenethyl ester
- CAS REGISTRY NUMBER :
- 103-52-6
- BEILSTEIN REFERENCE NO. :
- 1955788
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 5
- MOLECULAR FORMULA :
- C12-H16-O2
- MOLECULAR WEIGHT :
- 192.28
- WISWESSER LINE NOTATION :
- 3VO2R
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: 17,889,1979 ** ACUTE TOXICITY DATA **
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 4600 uL/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: 17,889,1979
- TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- 2 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JEENAI Journal of Economic Entomology. (Entomological Soc. of America, 4603 Calvert Rd., College Park, MD 20740) V.1- 1908- Volume(issue)/page/year: 48,139,1955
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- >5 mL/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: 17,889,1979
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Safety Information
| Personal Protective Equipment | Eyeshields;Gloves |
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| RIDADR | NONH for all modes of transport |
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| WGK Germany | 2 |
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| RTECS | ET5956200 |
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Synonyms
| 2-phenylethyl butanoate |
| MFCD00048718 |
| Butanoic acid, 2-phenylethyl ester |
| EINECS 203-119-8 |
| β-Phenylethyl butyrate |
| Phenethyl butyrate |
| 2-Phenylethyl butyrate |
