Introduction：Basic information about CAS 2216-45-7|4-Methylbenzyl acetate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 4-Methylbenzyl acetate |
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| CAS Number | 2216-45-7 | Molecular Weight | 164.201 |
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| Density | 1.0±0.1 g/cm3 | Boiling Point | 224.5±9.0 °C at 760 mmHg |
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| Molecular Formula | C10H12O2 | Melting Point | / |
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| MSDS | / | Flash Point | 98.0±17.1 °C |
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Names
| Name | (4-methylphenyl)methyl acetate |
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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 | 224.5±9.0 °C at 760 mmHg |
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| Molecular Formula | C10H12O2 |
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| Molecular Weight | 164.201 |
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| Flash Point | 98.0±17.1 °C |
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| Exact Mass | 164.083725 |
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| PSA | 26.30000 |
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| LogP | 2.39 |
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| Vapour Pressure | 0.1±0.4 mmHg at 25°C |
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| Index of Refraction | 1.505 |
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| InChIKey | WDCUPFMSLUIQBH-UHFFFAOYSA-N |
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| SMILES | CC(=O)OCc1ccc(C)cc1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- DA4940000
- CHEMICAL NAME :
- Benzenemethanol, 4-methyl-, acetate
- CAS REGISTRY NUMBER :
- 2216-45-7
- BEILSTEIN REFERENCE NO. :
- 2046163
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C10-H12-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: 30,79S,1992
- TYPE OF TEST :
- LDLo - Lowest published lethal dose
- 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: 30,79S,1992
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Safety Information
| Hazard Codes | Xn |
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| Risk Phrases | R36/37/38 |
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| Safety Phrases | S26-S36/37/39 |
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| RTECS | DA4940000 |
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| HS Code | 2915390090 |
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Customs
| HS Code | 2915390090 |
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| Summary | 2915390090. esters of acetic acid. VAT:17.0%. Tax rebate rate:13.0%. 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
| 4-Methylbenzyl ethanoate |
| MFCD00017234 |
| p-Xylyl acetate |
| p-methylbenzyl actate |
| p-Tolubenzyl acetate |
| Benzenemethanol, 4-methyl-, acetate |
| p-Acetoxymethyltoluene |
| 4-Methylbenzyl acetate |
| 4-tolyl acetate |
| p-Xylene, α-acetoxy |
| p-Methylbenzyl alcohol acetate |
| p-Methylbenzyl acetate |
| EINECS 218-689-3 |
