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

Names

[ CAS No. ]:
101931-71-9

[ 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

Related Compounds

  • 4-[(3S)-3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)heptanoyl]thiomorpholine-2-carboxylic acid
  • 3-[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-methoxybutanamido]cyclopentane-1-carboxylic acid
  • 3-[(2S,3S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-methylpentanamido]-2-hydroxypropanoic acid
  • (2S)-2-{2-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]-4-methylpentanamido}-3-hydroxypropanoic acid
  • 1-[2-cyclobutyl-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)acetyl]-4-hydroxypiperidine-4-carboxylic acid
  • 2-[4-(1,3-Thiazol-2-yloxy)piperidin-1-yl]-6-(trifluoromethyl)pyridine
  • 1-{2-[3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)phenyl]acetyl}-3-methylazetidine-3-carboxylic acid
  • (2R)-2-({2-[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)ethyl]-5-methyl-1,3-thiazol-4-yl}formamido)-3-hydroxypropanoic acid
  • 6-[1-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)cyclobutanecarbonyl]-6-azaspiro[3.4]octane-8-carboxylic acid
  • 2-{3-[(3R)-3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)hexanamido]cyclobutyl}acetic acid
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