6454-66-6

6454-66-6 structure

6454-66-6 structure

Name: 4-[3-(trifluoromethyl)anilino]pyrimidine-5-carboxylic acid
Chemical Name: 4-[3-(trifluoromethyl)anilino]pyrimidine-5-carboxylic acid
CAS Number: 6454-66-6
Molecular Formula: C₁₂H₈F₃N₃O₂
Molecular Weight: 283.20600
Create Date: 2016-05-02 15:40:40
Modify Date: 2024-02-28 11:46:28

Name	4-[3-(trifluoromethyl)anilino]pyrimidine-5-carboxylic acid
Synonyms	4-(3-Trifluoromethylanilino)pyrimidine-5-carboxylic acid

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

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