Propanoic acid, 3-((((phenylmethyl)amino)thioxomethyl)thio)-, methyl ester

Modify Date: 2024-01-09 08:53:21

Propanoic acid, 3-((((phenylmethyl)amino)thioxomethyl)thio)-, methyl ester Structure
Propanoic acid, 3-((((phenylmethyl)amino)thioxomethyl)thio)-, methyl ester structure
Common Name Propanoic acid, 3-((((phenylmethyl)amino)thioxomethyl)thio)-, methyl ester
CAS Number 56624-44-3 Molecular Weight 269.38300
Density 1.227g/cm3 Boiling Point 397.9ºC at 760 mmHg
Molecular Formula C12H15NO2S2 Melting Point N/A
MSDS N/A Flash Point 194.5ºC

 Names

Name methyl 3-(benzylcarbamothioylsulfanyl)propanoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.227g/cm3
Boiling Point 397.9ºC at 760 mmHg
Molecular Formula C12H15NO2S2
Molecular Weight 269.38300
Flash Point 194.5ºC
Exact Mass 269.05400
PSA 95.72000
LogP 2.74830
Index of Refraction 1.598

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UF5272000
CHEMICAL NAME :
Propionic acid, 3-mercapto-, methyl ester, ester with benzyldithiocarbamic acid
CAS REGISTRY NUMBER :
56624-44-3
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H15-N-O2-S2
MOLECULAR WEIGHT :
269.40

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 :
1590 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ARPMAS Archiv der Pharmazie (Weinheim, Germany) (VCH Pub., Inc., 303 NW 12th Ave., Deerfield Beach, FL 33441) V.51-261, 1835-1923; V.305- 1972- Volume(issue)/page/year: 309,161,1976

 Synonyms

Propionic acid,3-mercapto-,methyl ester,ester with benzyldithiocarbamic acid
3-benzylthiocarbamoylsulfanyl-propionic acid methyl ester
Propanoic acid,3-((((phenylmethyl)amino)thioxomethyl)thio)-,methyl ester
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