Introduction：Basic information about CAS 42779-82-8|Clopirac, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Clopirac |
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| CAS Number | 42779-82-8 | Molecular Weight | 263.71900 |
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| Density | 1.23g/cm3 | Boiling Point | 429.1ºC at 760mmHg |
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| Molecular Formula | C14H14ClNO2 | Melting Point | / |
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| MSDS | / | Flash Point | 213.3ºC |
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Names
| Name | 2-[1-(4-chlorophenyl)-2,5-dimethylpyrrol-3-yl]acetic acid |
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| Synonym | More Synonyms |
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Clopirac BiologicalActivity
| Description | Clopirac is a potent and orally active inhibitor of prostaglandin synthetase. Clopirac is an anti-inflammatory agent[1]. |
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| Related Catalog | Research Areas >>Inflammation/ImmunologySignaling Pathways >>Immunology/Inflammation >>PGE synthase |
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| Target | prostaglandin synthetase[1] |
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| References | [1]. Roba J, et al. Etude pharmacologique d'un nouvel anti-inflammatoire non stéroïdien, le clopirac [Pharmacological study of clopirac, a new anti-inflammatory agent (author's transl)]. J Belge Rhumatol Med Phys. 1975;30 Spec no:3-24. |
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Chemical & Physical Properties
| Density | 1.23g/cm3 |
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| Boiling Point | 429.1ºC at 760mmHg |
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| Molecular Formula | C14H14ClNO2 |
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| Molecular Weight | 263.71900 |
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| Flash Point | 213.3ºC |
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| Exact Mass | 263.07100 |
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| PSA | 42.23000 |
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| LogP | 3.37460 |
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| InChIKey | SJCRQMUYEQHNTC-UHFFFAOYSA-N |
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| SMILES | Cc1cc(CC(=O)O)c(C)n1-c1ccc(Cl)cc1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- UX9277490
- CHEMICAL NAME :
- 1H-Pyrrole-3-acetic acid, 1-(4-chlorophenyl)-2,5-dimethyl-
- CAS REGISTRY NUMBER :
- 42779-82-8
- BEILSTEIN REFERENCE NO. :
- 0480479
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C14-H14-Cl-N-O2
- MOLECULAR WEIGHT :
- 263.74
- WISWESSER LINE NOTATION :
- T5NJ AR DG& B1 C1VQ E1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 780 mg/kg
- TOXIC EFFECTS :
- Behavioral - analgesia Biochemical - Metabolism (Intermediary) - effect on inflammation or mediation of inflammation
- REFERENCE :
- EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 11,173,1976
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Safety Information
Customs
| HS Code | 2933990090 |
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| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Synonyms
| 1-p-Chlorphenyl-2,5-dimethyl-pyrrol-3-essigsaeure |
| CP 172AP |
| EINECS 255-938-5 |
| CLOPIRAC |
