Introduction：Basic information about CAS 141-73-1|3',4',5'-Trifluoroacetophenone, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3',4',5'-Trifluoroacetophenone |
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| CAS Number | 141-73-1 | Molecular Weight | 132.20100 |
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| Density | 0.89g/cm3 | Boiling Point | 172.7ºC at 760mmHg |
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| Molecular Formula | C7H16O2 | Melting Point | / |
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| MSDS | / | Flash Point | 53.4ºC |
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Names
| Name | 4-methoxy-4-methylpentan-2-ol |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 0.89g/cm3 |
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| Boiling Point | 172.7ºC at 760mmHg |
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| Molecular Formula | C7H16O2 |
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| Molecular Weight | 132.20100 |
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| Flash Point | 53.4ºC |
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| Exact Mass | 132.11500 |
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| PSA | 29.46000 |
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| LogP | 1.18230 |
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| Vapour Pressure | 0.413mmHg at 25°C |
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| Index of Refraction | 1.421 |
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| InChIKey | OMSLSFZIEVFEIH-UHFFFAOYSA-N |
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| SMILES | COC(C)(C)CC(C)O |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- SA7000000
- CHEMICAL NAME :
- 2-Pentanol, 4-methoxy-4-methyl-
- CAS REGISTRY NUMBER :
- 141-73-1
- BEILSTEIN REFERENCE NO. :
- 1734421
- LAST UPDATED :
- 199712
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C7-H16-O2
- MOLECULAR WEIGHT :
- 132.23
- WISWESSER LINE NOTATION :
- QY1&1X1&1&O1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 2 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- SCCUR* Shell Chemical Company. Unpublished Report. (2401 Crow Canyon Rd., San Romon, CA 94583) Volume(issue)/page/year: -,6,1961
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 2650 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- SCCUR* Shell Chemical Company. Unpublished Report. (2401 Crow Canyon Rd., San Romon, CA 94583) Volume(issue)/page/year: -,6,1961
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Safety Information
| Hazard Codes | Xi |
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| Risk Phrases | 36/37/38 |
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| Safety Phrases | 24/25 |
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| RTECS | SA7000000 |
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| HS Code | 2909499000 |
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Customs
| HS Code | 2909499000 |
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| Summary | 2909499000. ether-alcohols and their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:9.0%. . MFN tariff:5.5%. General tariff:30.0% |
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Synonyms
| Pent-Oxol |
| AC1L2WBS |
| 4-methoxy-4-methyl-pentan-2-ol |
| MFCD00046654 |
| Pent-Oxol Solvent |
| 2-Hydroxy-4-methyl-4-methoxy-pentan |
| CTK4C2773 |
| 2-Pentanol,4-methoxy-4-methyl |
| 4-METHOXY-4-METHYL-2-PENTANOL |
