3-[[2-(trifluoromethyl)phenyl]carbamothioylamino]propanoic acid

Modify Date: 2025-08-31 22:42:45

3-[[2-(trifluoromethyl)phenyl]carbamothioylamino]propanoic acid Structure
3-[[2-(trifluoromethyl)phenyl]carbamothioylamino]propanoic acid structure
Common Name 3-[[2-(trifluoromethyl)phenyl]carbamothioylamino]propanoic acid
CAS Number 519056-57-6 Molecular Weight 292.27700
Density 1.458g/cm3 Boiling Point 393.8ºC at 760 mmHg
Molecular Formula C11H11F3N2O2S Melting Point 124ºC
MSDS N/A Flash Point 192ºC

 Names

Name 3-[[2-(trifluoromethyl)phenyl]carbamothioylamino]propanoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.458g/cm3
Boiling Point 393.8ºC at 760 mmHg
Melting Point 124ºC
Molecular Formula C11H11F3N2O2S
Molecular Weight 292.27700
Flash Point 192ºC
Exact Mass 292.04900
PSA 93.45000
LogP 2.93040
Index of Refraction 1.585
InChIKey XYMHGKUYYQCCBV-UHFFFAOYSA-N
SMILES O=C(O)CCNC(=S)Nc1ccccc1C(F)(F)F

 Synonyms

HMS561I14
3-({[2-(trifluoromethyl)anilino]carbothioyl}amino)propanoic acid
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