Introduction：Basic information about CAS 17371-99-2|2(3H)-Benzoxazolethione,5-phenyl-, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 2(3H)-Benzoxazolethione,5-phenyl- |
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| CAS Number | 17371-99-2 | Molecular Weight | 227.28200 |
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| Density | 1.36g/cm3 | Boiling Point | 384.2ºC at 760 mmHg |
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| Molecular Formula | C13H9NOS | Melting Point | 213 °C |
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| MSDS | / | Flash Point | 186.2ºC |
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Names
| Name | 5-Phenylbenzoxazole-2-thiol |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.36g/cm3 |
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| Boiling Point | 384.2ºC at 760 mmHg |
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| Melting Point | 213 °C |
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| Molecular Formula | C13H9NOS |
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| Molecular Weight | 227.28200 |
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| Flash Point | 186.2ºC |
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| Exact Mass | 227.04000 |
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| PSA | 64.83000 |
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| LogP | 3.78350 |
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| Vapour Pressure | 4.16E-06mmHg at 25°C |
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| Index of Refraction | 1.731 |
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| InChIKey | QKLMWNVNJBXKRG-UHFFFAOYSA-N |
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| SMILES | S=c1[nH]c2cc(-c3ccccc3)ccc2o1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- DM4888000
- CHEMICAL NAME :
- 2-Benzoxazolethiol, 5-phenyl-
- CAS REGISTRY NUMBER :
- 17371-99-2
- LAST UPDATED :
- 197901
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C13-H9-N-O-S
- MOLECULAR WEIGHT :
- 227.29
- WISWESSER LINE NOTATION :
- T56 BN DOJ CSH HR
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#03240
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Safety Information
Customs
| HS Code | 2934999090 |
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| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Synonyms
| 5-Phenylbenzoxazoline-2(3H)-thione |
| 2-Mercapto-5-phenylbenzoxazole |
| 5-phenyl-3H-1,3-benzoxazole-2-thione |
