2-Buten-1-one, 3-(4-(4-fluorophenyl)-1-piperazinyl)-1-phenyl-

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Names

[ CAS No. ]:
76691-03-7

[ Name ]:
2-Buten-1-one, 3-(4-(4-fluorophenyl)-1-piperazinyl)-1-phenyl-

Chemical & Physical Properties

[ Density]:
1.171g/cm3

[ Boiling Point ]:
472.9ºC at 760 mmHg

[ Molecular Formula ]:
C20H21FN2O

[ Molecular Weight ]:
324.39200

[ Flash Point ]:
239.8ºC

[ Exact Mass ]:
324.16400

[ PSA ]:
23.55000

[ LogP ]:
3.73730

[ Index of Refraction ]:
1.588

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
EM9936200
CHEMICAL NAME :
2-Buten-1-one, 3-(4-(4-fluorophenyl)-1-piperazinyl)-1-phenyl-
CAS REGISTRY NUMBER :
76691-03-7
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C20-H21-F-N2-O
MOLECULAR WEIGHT :
324.43

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
IJSBDB Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. (Publications & Information Directorate, Council of Scientific and Industrial Research (CSIR), Hillside Rd., New Delhi 110 012, India) V.14B- 1976- Volume(issue)/page/year: 19,695,1980

Synthetic Route

Precursor & DownStream

Precursor

  • 1-(4-Fluorophenyl)piperazine
  • 1-Phenylbutane-1,3-dione

DownStream


Related Compounds

  • O-[2-methyl-2-(5-phenylthiophen-2-yl)propyl]hydroxylamine
  • methyl 4-(2-hydroxypropan-2-yl)-1-methyl-1H-pyrrole-2-carboxylate
  • 3-Amino-3-(but-1-en-1-yl)cyclobutan-1-ol
  • 1-(Cyclohex-3-en-1-yl)-2-fluoroethan-1-ol
  • 1,1-Difluoro-2-(4-fluoro-3-nitrophenyl)propan-2-amine
  • 4-(1-amino-2-methylpropan-2-yl)-2-fluoro-N,N-dimethylaniline
  • 2-(2-Phenylpropan-2-yl)cyclopropan-1-amine
  • tert-butyl N-[5-(piperidin-4-yl)pyrimidin-2-yl]carbamate
  • 1-{2-[1-(2-methylpropyl)-1H-pyrazol-4-yl]propan-2-yl}cyclopropan-1-amine
  • 7-[(2S)-oxiran-2-yl]-1H-indazole
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