Introduction:Basic information about CAS 67785-77-7|Dimethyl Benzyl Carbinyl Propionate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Dimethyl Benzyl Carbinyl Propionate |
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| CAS Number | 67785-77-7 | Molecular Weight | 206.28100 |
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| Density | 0.99 g/cm3 | Boiling Point | 276.3ºC at 760 mmHg |
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| Molecular Formula | C13H18O2 | Melting Point | / |
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| MSDS | / | Flash Point | 104.2ºC |
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Names
| Name | Dimethyl Benzyl Carbinyl Propionate |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 0.99 g/cm3 |
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| Boiling Point | 276.3ºC at 760 mmHg |
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| Molecular Formula | C13H18O2 |
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| Molecular Weight | 206.28100 |
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| Flash Point | 104.2ºC |
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| Exact Mass | 206.13100 |
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| PSA | 26.30000 |
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| LogP | 2.96090 |
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| Index of Refraction | 1.494 |
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| InChIKey | BLKIYRRGHOQSPP-UHFFFAOYSA-N |
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| SMILES | CCC(=O)OC(C)(C)Cc1ccccc1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- DA0512000
- CHEMICAL NAME :
- Benzene ethanol, alpha,alpha-dimethyl-, propanoate
- CAS REGISTRY NUMBER :
- 67785-77-7
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 4
- MOLECULAR FORMULA :
- C13-H18-O2
- MOLECULAR WEIGHT :
- 206.31
- WISWESSER LINE NOTATION :
- 2VOX1&1&1R
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: 18,669,1980 ** 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: 18,669,1980
- 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: 18,669,1980
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Synonyms
| (2-methyl-1-phenylpropan-2-yl) propanoate |