21494-80-4

21494-80-4 structure

21494-80-4 structure

Name: ethyl 3-benzyl-4-hydroxy-4-methyl-2-sulfanylidene-1,3-thiazolidine-5-carboxylate
Chemical Name: ethyl 3-benzyl-4-hydroxy-4-methyl-2-sulfanylidene-1,3-thiazolidine-5-carboxylate
CAS Number: 21494-80-4
Molecular Formula: C₁₄H₁₇NO₃S₂
Molecular Weight: 311.42000
Create Date: 2017-07-20 10:39:48
Modify Date: 2024-01-21 18:15:07

Name	ethyl 3-benzyl-4-hydroxy-4-methyl-2-sulfanylidene-1,3-thiazolidine-5-carboxylate
Synonyms	ethyl 3-benzyl-4-hydroxy-4-methyl-2-thioxo-1,3-thiazolidine-5-carboxylate 5-Thiazolidinecarboxylic acid,3-benzyl-4-hydroxy-4-methyl-2-thioxo-,ethyl ester 3-Benzyl-4-hydroxy-4-methyl-2-thioxo-5-thiazolidinecarboxylic acid ethyl ester

Molecular Formula	C₁₄H₁₇NO₃S₂
Molecular Weight	311.42000
Exact Mass	311.06500
PSA	107.16000
LogP	2.09840
Vapour Pressure	8.58E-09mmHg at 25°C

CHEMICAL IDENTIFICATION

RTECS NUMBER :: XJ5425520

CHEMICAL NAME :: 5-Thiazolidinecarboxylic acid, 3-benzyl-4-hydroxy-4-methyl-2-thioxo-, ethyl ester

CAS REGISTRY NUMBER :: 21494-80-4

BEILSTEIN REFERENCE NO. :: 0289326

LAST UPDATED :: 199612

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C14-H17-N-O3-S2

MOLECULAR WEIGHT :: 311.44

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 400 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 19,558,1969

TYPE OF TEST :: LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 400 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 21,121,1971