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

Modify Date: 2025-11-06 09:49:39

2-Buten-1-one, 1-(4-fluorophenyl)-3-(4-(4-fluorophenyl)-1-piperazinyl)- Structure
2-Buten-1-one, 1-(4-fluorophenyl)-3-(4-(4-fluorophenyl)-1-piperazinyl)- structure
 Common Name 2-Buten-1-one, 1-(4-fluorophenyl)-3-(4-(4-fluorophenyl)-1-piperazinyl)-
CAS Number 76691-14-0 Molecular Weight 342.38200
Density 1.217g/cm3 Boiling Point 481.7ºC at 760 mmHg
Molecular Formula C20H20F2N2O Melting Point N/A
MSDS N/A Flash Point 245.1ºC

 Names

Name (Z)-1-(4-fluorophenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]but-2-en-1-one

 Chemical & Physical Properties

Density 1.217g/cm3
Boiling Point 481.7ºC at 760 mmHg
Molecular Formula C20H20F2N2O
Molecular Weight 342.38200
Flash Point 245.1ºC
Exact Mass 342.15400
PSA 23.55000
LogP 3.87640
Index of Refraction 1.578
InChIKey DRXUFBJIDRCRHH-PFONDFGASA-N
SMILES CC(=CC(=O)c1ccc(F)cc1)N1CCN(c2ccc(F)cc2)CC1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
EM9935700
CHEMICAL NAME :
2-Buten-1-one, 1-(4-fluorophenyl)-3-(4-(4-fluorophenyl)-1-piperaziny l)-
CAS REGISTRY NUMBER :
76691-14-0
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C20-H20-F2-N2-O
MOLECULAR WEIGHT :
342.42

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
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Chemsrc provides CAS#:76691-14-0 MSDS, density, melting point, boiling point, structure, etc. Its name is 2-Buten-1-one, 1-(4-fluorophenyl)-3-(4-(4-fluorophenyl)-1-piperazinyl)->> amp version: 2-Buten-1-one, 1-(4-fluorophenyl)-3-(4-(4-fluorophenyl)-1-piperazinyl)-

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