4-[3-(trifluoromethyl)anilino]pyrimidine-5-carboxylic acid
Names
[ CAS No. ]:
6454-66-6
[ Name ]:
4-[3-(trifluoromethyl)anilino]pyrimidine-5-carboxylic acid
[Synonym ]:
4-(3-Trifluoromethylanilino)pyrimidine-5-carboxylic acid
Chemical & Physical Properties
[ Density]:
1.506g/cm3
[ Boiling Point ]:
407.6ºC at 760 mmHg
[ Molecular Formula ]:
C12H8F3N3O2
[ Molecular Weight ]:
283.20600
[ Flash Point ]:
200.3ºC
[ Exact Mass ]:
283.05700
[ PSA ]:
75.11000
[ LogP ]:
3.01020
[ Index of Refraction ]:
1.593
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- UV7885000
- CHEMICAL NAME :
- 5-Pyrimidinecarboxylic acid, 4-(alpha,alpha,alpha-trifluoro-m-toluidino)-
- CAS REGISTRY NUMBER :
- 6454-66-6
- BEILSTEIN REFERENCE NO. :
- 0553152
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C12-H8-F3-N3-O2
- MOLECULAR WEIGHT :
- 283.23
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 1782 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 10,954,1967