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

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Names

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

[Synonym ]:
6-<4-(3-trifluoromethylphenyl)-1-piperazinyl>acetyl-3-methyl benzoxazolinone
2(3H)-Benzoxalzolone,3-methyl-6-((4-(3-(trifluoromethyl)phenyl)-1-piperazinyl)acetyl)

Chemical & Physical Properties

[ 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

Toxicological Information

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

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

6-(2-bromoacetyl)-3-methyl-2(3H)-benzoxazolone
N-(3-Trifluoromethylphenyl)piperazine

DownStream

Related Compounds

(R)-(4-(1-((Tert-butoxycarbonyl)amino)propan-2-YL)phenyl)boronic acid
4-[1-(3,6-Dimethylpyrazin-2-yl)pyrrolidine-3-carbonyl]thiomorpholine
4,6-Dimethyl-2-[3-(pyrrolidine-1-carbonyl)azetidin-1-yl]pyrimidine
N-[1-(5-methyl-1,3-thiazol-2-yl)piperidin-4-yl]methanesulfonamide
4-[1-(5-Fluoropyridin-2-yl)azetidine-3-carbonyl]morpholine
4-[1-(3-Fluoropyridin-2-yl)piperidine-4-carbonyl]morpholine
N-Methyl-L-phenylalanine benzyl ester HCl
6-Methyl-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]pyridine-3-carbonitrile
4-[1-(6-Methylpyridin-2-yl)pyrrolidine-3-carbonyl]morpholine
4-[1-(5-Chloropyridin-2-yl)pyrrolidine-3-carbonyl]morpholine

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