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China
Product Name: 2-Buten-1-one, 3-(4-(4-fluorophenyl)-1-piperazinyl)-1-phenyl-
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76691-03-7

76691-03-7 structure

76691-03-7 structure

Name: 2-Buten-1-one, 3-(4-(4-fluorophenyl)-1-piperazinyl)-1-phenyl-
Chemical Name: 3-[4-(4-fluorophenyl)piperazin-1-yl]-1-phenylbut-2-en-1-one
CAS Number: 76691-03-7
Molecular Formula: C₂₀H₂₁FN₂O
Molecular Weight: 324.39200
Create Date: 2017-03-23 04:40:42
Modify Date: 2025-09-23 23:19:58

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

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

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

2252-63-3 structure

2252-63-3

93-91-4 structure

93-91-4

~%

76691-03-7 structure

76691-03-7

Literature: Pratap, Ram; Gupta, R. C.; Srimal, R. C.; Anand, Nitya Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1980 , vol. 19, # 8 p. 695 - 698

Precursor 2
2252-63-3 93-91-4
DownStream 0

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