Introduction:Basic information about CAS 40198-53-6|2-[[4,5-bis(4-chlorophenyl)-1,3-oxazol-2-yl]sulfanyl]propanoic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 2-[[4,5-bis(4-chlorophenyl)-1,3-oxazol-2-yl]sulfanyl]propanoic acid |
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| CAS Number | 40198-53-6 | Molecular Weight | 394.27200 |
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| Density | 1.49g/cm3 | Boiling Point | 536ºC at 760mmHg |
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| Molecular Formula | C18H13Cl2NO3S | Melting Point | / |
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| MSDS | / | Flash Point | 278ºC |
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Names
| Name | 2-[[4,5-bis(4-chlorophenyl)-1,3-oxazol-2-yl]sulfanyl]propanoic acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.49g/cm3 |
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| Boiling Point | 536ºC at 760mmHg |
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| Molecular Formula | C18H13Cl2NO3S |
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| Molecular Weight | 394.27200 |
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| Flash Point | 278ºC |
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| Exact Mass | 392.99900 |
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| PSA | 88.63000 |
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| LogP | 5.88060 |
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| Index of Refraction | 1.678 |
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| InChIKey | WGDADRBTCPGSDG-UHFFFAOYSA-N |
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| SMILES | CC(Sc1nc(-c2ccc(Cl)cc2)c(-c2ccc(Cl)cc2)o1)C(=O)O |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- UA2451700
- CHEMICAL NAME :
- Propanoic acid, 2-((4,5-bis(4-chlorophenyl)-2-oxazolyl)thio)-
- CAS REGISTRY NUMBER :
- 40198-53-6
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C18-H13-Cl2-N-O3-S
- MOLECULAR WEIGHT :
- 394.28
HEALTH HAZARD DATAACUTE TOXICITY DATAMUTATION DATA - TYPE OF TEST :
- Sister chromatid exchange
- TEST SYSTEM :
- Human Lymphocyte
- DOSE/DURATION :
- 10 mg/L
- REFERENCE :
- RBGED3 Revista Brasileira de Genetica. Brazilian Journal of Genetics. (Dr. F.A. Moura Duarte, Dep. de Genetica, Faculdade de Medicina de Ribeirao Preto, 14.100 Ribeirao Preto, Sao Paulo, Brazil) V.1- 1978- Volume(issue)/page/year: 9,321,1986
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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
| 2-[4,5-bis-(4-chloro-phenyl)-oxazol-2-ylsulfanyl]-propionic acid |
| Mercaptooxazolyl carboxylic acid |
| 2-(4,5-Bis-p-chlorphenyl-2-oxazolylmercapto)propionsaeure |
| Propanoic acid,2-((4,5-bis(4-chlorophenyl)-2-oxazolyl)thio) |
| Tioxaprofen |
| 2-(4,5-BIS-P-CHLOROPHENYLOXAZOL-2-YL-MERCAPTO)-PROPIONIC ACID |
| 2-(4,5-bis-p-chlorophenyl-2-oxazolyl-mercapto)-propionic acid |
| 2-((4,5-Bis(p-chlorophenyl)-2-oxazolyl)thio)propionic acid |
| 2-{[4,5-bis-(4-chlorophenyl)-2-oxazolyl]thio}propanoic acid |
| Tioxaprofeno [INN-Spanish] |
| EINECS 254-834-7 |
| Tioxaprofenum [INN-Latin] |
| Tioxaprofene [INN-French] |