Introduction：Basic information about CAS 1825-19-0|pentachloromethylthiobenzene, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | pentachloromethylthiobenzene |
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| CAS Number | 1825-19-0 | Molecular Weight | 296.429 |
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| Density | 1.7±0.1 g/cm3 | Boiling Point | 318.5±42.0 °C at 760 mmHg |
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| Molecular Formula | C7H3Cl5S | Melting Point | 95 °C |
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| MSDS | ChineseUSA | Flash Point | 139.6±25.0 °C |
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Names
| Name | 1,2,3,4,5-pentachloro-6-methylsulfanylbenzene |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.7±0.1 g/cm3 |
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| Boiling Point | 318.5±42.0 °C at 760 mmHg |
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| Melting Point | 95 °C |
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| Molecular Formula | C7H3Cl5S |
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| Molecular Weight | 296.429 |
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| Flash Point | 139.6±25.0 °C |
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| Exact Mass | 293.839813 |
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| PSA | 25.30000 |
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| LogP | 5.81 |
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| Vapour Pressure | 0.0±0.7 mmHg at 25°C |
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| Index of Refraction | 1.641 |
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| InChIKey | LGZZJTIUEJNNKV-UHFFFAOYSA-N |
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| SMILES | CSc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- WQ5520000
- CHEMICAL NAME :
- Sulfide, methyl pentachlorophenyl
- CAS REGISTRY NUMBER :
- 1825-19-0
- BEILSTEIN REFERENCE NO. :
- 2214412
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C7-H3-Cl5-S
- MOLECULAR WEIGHT :
- 296.41
- WISWESSER LINE NOTATION :
- GR BG CG DG EG FS1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 8700 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- ARTODN Archives of Toxicology. (Springer-Verlag, Heidelberger Pl. 3, D-1000 Berlin 33, Fed. Rep. Ger.) V.32- 1974- Volume(issue)/page/year: 51,329,1982
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Safety Information
| Hazard Statements | H413 |
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| Personal Protective Equipment | Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter |
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| Safety Phrases | S22-S24/25 |
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| RIDADR | NONH for all modes of transport |
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| RTECS | WQ5520000 |
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| HS Code | 2930909090 |
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Customs
| HS Code | 2930909090 |
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| Summary | 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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Articles13
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| Comparison of bifunctional chelates for (64)Cu antibody imaging. Eur. J. Nucl. Med. Mol. Imaging 37(11) , 2117-26, (2010) Improved bifunctional chelates (BFCs) are needed to facilitate efficient (64)Cu radiolabeling of monoclonal antibodies (mAbs) under mild conditions and to yield stable, target-specific agents. The uti... | |
| (68)Ga small peptide imaging: comparison of NOTA and PCTA. Bioconjug. Chem. 23(11) , 2239-46, (2012) In this study, a bifunctional version of the chelate PCTA was compared to the analogous NOTA derivative for peptide conjugation, (68)Ga radiolabeling, and small peptide imaging. Both p-SCN-Bn-PCTA and... | |
| The metabolism of pentachloromethylthiobenzene in germ-free and conventional rats. Xenobiotica 11(3) , 173-8, (1981)
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Synonyms
| PENTACHLOROTHIOANISOLE |
| 1,2,3,4,5-Pentachloro-6-(methylsulfanyl)benzene |
| Pctas |
| Methylthiopentachlorobenzene |
| Methyl-pentachlorophenylsulfide |
| Pentachlorphenyl-methyl-sufid |
| EINECS 217-363-8 |
| MFCD00013622 |
| Methylpentachlorophenyl sulfide |
| 1,2,3,5,6-Pentachloro-4-(methylthio)benzene |
| Methylthiopentachlorbenzol |
| Methyl pentachlorophenyl sulfide |
| Benzene, 1,2,3,4,5-pentachloro-6-(methylthio)- |
| pentachloromethylthiobenzene |
| Methyl-pentachlorphenyl-sulfid |
