Introduction：Basic information about CAS 2879-60-9|Pentachlorophenyl trichloroacetate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Pentachlorophenyl trichloroacetate |
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| CAS Number | 2879-60-9 | Molecular Weight | 411.70800 |
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| Density | 1.862g/cm3 | Boiling Point | 406ºC at 760mmHg |
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| Molecular Formula | C8Cl8O2 | Melting Point | 129ºC |
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| MSDS | / | Flash Point | 160.7ºC |
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Names
| Name | (2,3,4,5,6-pentachlorophenyl) 2,2,2-trichloroacetate |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.862g/cm3 |
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| Boiling Point | 406ºC at 760mmHg |
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| Melting Point | 129ºC |
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| Molecular Formula | C8Cl8O2 |
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| Molecular Weight | 411.70800 |
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| Flash Point | 160.7ºC |
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| Exact Mass | 407.74100 |
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| PSA | 26.30000 |
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| LogP | 6.22920 |
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| Vapour Pressure | 8.4E-07mmHg at 25°C |
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| Index of Refraction | 1.609 |
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| InChIKey | WMUFBMFZOHGUPA-UHFFFAOYSA-N |
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| SMILES | O=C(Oc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl)C(Cl)(Cl)Cl |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- SM6670000
- CHEMICAL NAME :
- Phenol, pentachloro-, trichloroacetate
- CAS REGISTRY NUMBER :
- 2879-60-9
- BEILSTEIN REFERENCE NO. :
- 1890350
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C8-Cl8-O2
- MOLECULAR WEIGHT :
- 411.68
- WISWESSER LINE NOTATION :
- GXGGVOR BG CG DG EG FG
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 180 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#03667
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Safety Information
| RTECS | SM6670000 |
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| HS Code | 2915400090 |
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Customs
| HS Code | 2915400090 |
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| Summary | 2915400090 mono-, di- or trichloroacetic acids, their salts and esters |
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Synonyms
| Acetic acid,trichloro-,pentachlorophenyl ester |
| pentachlorophenol trichloroacetate |
| TCA-O-PCP |
| Trichloroacetic Acid Pentachlorophenyl Ester |
| Trichlor-essigsaeure-pentachlorphenylester |
| Pentachlorphenyl-trichloracetat |
| Perchlorophenyl 2,2,2-trichloroacetate |
| Phenol,pentachloro-,trichloroacetate |
| Pentachlorophenyl trichloroacetate |
