Introduction：Basic information about CAS 3696-23-9|4-CHLOROPHENYLTHIOUREA, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 4-CHLOROPHENYLTHIOUREA |
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| CAS Number | 3696-23-9 | Molecular Weight | 186.66200 |
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| Density | 1.441g/cm3 | Boiling Point | 298.7ºC at 760 mmHg |
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| Molecular Formula | C7H7ClN2S | Melting Point | 177-181 °C |
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| MSDS | / | Flash Point | 134.5ºC |
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Names
| Name | 4-Chlorophenylthiourea |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.441g/cm3 |
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| Boiling Point | 298.7ºC at 760 mmHg |
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| Melting Point | 177-181 °C |
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| Molecular Formula | C7H7ClN2S |
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| Molecular Weight | 186.66200 |
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| Flash Point | 134.5ºC |
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| Exact Mass | 186.00200 |
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| PSA | 70.14000 |
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| LogP | 2.76880 |
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| Index of Refraction | 1.727 |
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| InChIKey | XVEFWRUIYOXUGG-UHFFFAOYSA-N |
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| SMILES | NC(=S)Nc1ccc(Cl)cc1 |
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| Storage condition | Poison room |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- YS7175000
- CHEMICAL NAME :
- Urea, 1-(p-chlorophenyl)-2-thio-
- CAS REGISTRY NUMBER :
- 3696-23-9
- BEILSTEIN REFERENCE NO. :
- 0973258
- LAST UPDATED :
- 199712
- DATA ITEMS CITED :
- 4
- MOLECULAR FORMULA :
- C7-H7-Cl-N2-S
- MOLECULAR WEIGHT :
- 186.67
- WISWESSER LINE NOTATION :
- SUYZMR DG
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 15 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 90,260,1947
- TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- 35 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JMPCAS Journal of Medicinal and Pharmaceutical Chemistry. (Washington, DC) V.1-5, 1959-62. For publisher information, see JMCMAR. Volume(issue)/page/year: 4,147,1961
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Safety Information
| Hazard Codes | T+ |
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| Risk Phrases | R28 |
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| Safety Phrases | S45-S36/37/39-S28A-S26-S1 |
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| RIDADR | 2811 |
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| RTECS | YS7175000 |
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| Packaging Group | II |
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| Hazard Class | 6.1 |
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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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Synonyms
| (4-Chlorophenyl)thiourea |
| EINECS 223-022-4 |
| MFCD00022168 |
| N-(4-Chlorophenyl)thiourea |
| 1-(4-Chlorophenyl)thiourea |
