2-Benzoxazolinone, 3-methyl-6-((4-(alpha,alpha,alpha-trifluoro-m-tolyl)-4-piperazinyl)acetyl)-

Modify Date: 2024-01-18 07:55:10

2-Benzoxazolinone, 3-methyl-6-((4-(alpha,alpha,alpha-trifluoro-m-tolyl)-4-piperazinyl)acetyl)- structure	Common Name	2-Benzoxazolinone, 3-methyl-6-((4-(alpha,alpha,alpha-trifluoro-m-tolyl)-4-piperazinyl)acetyl)-
	CAS Number	82608-05-7	Molecular Weight	419.39700
	Density	1.348g/cm3	Boiling Point	552.6ºC at 760 mmHg
	Molecular Formula	C₂₁H₂₀F₃N₃O₃	Melting Point	N/A
	MSDS	N/A	Flash Point	288ºC

Name	3-methyl-6-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]acetyl]-1,3-benzoxazol-2-one
Synonym	More Synonyms

Density	1.348g/cm3
Boiling Point	552.6ºC at 760 mmHg
Molecular Formula	C₂₁H₂₀F₃N₃O₃
Molecular Weight	419.39700
Flash Point	288ºC
Exact Mass	419.14600
PSA	58.69000
LogP	3.15810
Index of Refraction	1.571

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DM5276530

CHEMICAL NAME :: 2-Benzoxazolinone, 3-methyl-6-((4-(alpha,alpha,alpha-trifluoro-m-tolyl)- 4-piperazinyl) acetyl)-

CAS REGISTRY NUMBER :: 82608-05-7

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C21-H20-F3-N3-O3

MOLECULAR WEIGHT :: 419.44

WISWESSER LINE NOTATION :: T56 BNVOJ B1 GV1- AT6N DNTJ DR CXFFF

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 1500 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 32,604,1982

6-(2-bromoacety...

CAS#:79851-85-7

N-(3-Trifluorom...

CAS#:15532-75-9

~76%

2-Benzoxazolino...

CAS#:82608-05-7

Literature: Bermann; Berthelot; Bonte; Debaert; Lesieur; Brunet; Cazin; Luyckx Arzneimittel-Forschung/Drug Research, 1982 , vol. 32, # 6 p. 604 - 610

Precursor 2
CAS#:79851-85-7 6-(2-bromoacety... CAS#:15532-75-9 N-(3-Trifluorom...
DownStream 0

6-<4-(3-trifluoromethylphenyl)-1-piperazinyl>acetyl-3-methyl benzoxazolinone

2(3H)-Benzoxalzolone,3-methyl-6-((4-(3-(trifluoromethyl)phenyl)-1-piperazinyl)acetyl)

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2-Benzoxazolinone, 3-methyl-6-((4-(alpha,alpha,alpha-trifluoro-m-tolyl)-4-piperazinyl)acetyl)-

Names

Chemical & Physical Properties

Toxicological Information

CHEMICAL IDENTIFICATION

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

Synthetic Route

Precursor & DownStream

Synonyms