[(E)-[5,5,5-trifluoro-4-hydroxy-1-phenyl-4-(trifluoromethyl)pentan-2-ylidene]amino]thiourea

Modify Date: 2025-09-28 21:09:59

[(E)-[5,5,5-trifluoro-4-hydroxy-1-phenyl-4-(trifluoromethyl)pentan-2-ylidene]amino]thiourea Structure
[(E)-[5,5,5-trifluoro-4-hydroxy-1-phenyl-4-(trifluoromethyl)pentan-2-ylidene]amino]thiourea structure
 Common Name [(E)-[5,5,5-trifluoro-4-hydroxy-1-phenyl-4-(trifluoromethyl)pentan-2-ylidene]amino]thiourea
CAS Number 101931-71-9 Molecular Weight 373.31700
Density 1.44g/cm3 Boiling Point 439ºC at 760mmHg
Molecular Formula C13H13F6N3OS Melting Point N/A
MSDS N/A Flash Point 219.3ºC

 Names

Name [(E)-[5,5,5-trifluoro-4-hydroxy-1-phenyl-4-(trifluoromethyl)pentan-2-ylidene]amino]thiourea

 Chemical & Physical Properties

Density 1.44g/cm3
Boiling Point 439ºC at 760mmHg
Molecular Formula C13H13F6N3OS
Molecular Weight 373.31700
Flash Point 219.3ºC
Exact Mass 373.06800
PSA 107.27000
LogP 3.77570
Vapour Pressure 1.75E-08mmHg at 25°C
Index of Refraction 1.505

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
SA9140000
CHEMICAL NAME :
2-Pentanone, 2-hydroxy-5-phenyl-1,1,1-trifluoro-2-(trifluoromethyl )-, 3-thiosemicarbazone
CAS REGISTRY NUMBER :
101931-71-9
LAST UPDATED :
198609
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H13-F6-N3-O-S
MOLECULAR WEIGHT :
373.35
WISWESSER LINE NOTATION :
SUYZMNUY1R&1XQXFFFXFFF

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
56 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#09410
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Chemsrc provides CAS#:101931-71-9 MSDS, density, melting point, boiling point, structure, etc. Its name is [(E)-[5,5,5-trifluoro-4-hydroxy-1-phenyl-4-(trifluoromethyl)pentan-2-ylidene]amino]thiourea>> amp version: [(E)-[5,5,5-trifluoro-4-hydroxy-1-phenyl-4-(trifluoromethyl)pentan-2-ylidene]amino]thiourea

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