1-(3,4-METHYLENEDIOXY-PHENYL)-4,4-DIMETHYL-PENT-1-EN-3-ONE

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Names

[ CAS No. ]:
2419-68-3

[ Name ]:
1-(3,4-METHYLENEDIOXY-PHENYL)-4,4-DIMETHYL-PENT-1-EN-3-ONE

[Synonym ]:
MFCD00017633

Chemical & Physical Properties

[ Density]:
1.134±0.06 g/cm3(Predicted)

[ Boiling Point ]:
358.8±11.0 °C(Predicted)

[ Melting Point ]:
91-93 °C

[ Molecular Formula ]:
C₁₄H₁₆O₃

[ Molecular Weight ]:
232.27500

[ Exact Mass ]:
232.11000

[ PSA ]:
35.53000

[ LogP ]:
3.04370

[ Storage condition ]:
-20°C

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: SB3851700

CHEMICAL NAME :: 1-Penten-3-one, 1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-

CAS REGISTRY NUMBER :: 2419-68-3

LAST UPDATED :: 199109

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C14-H16-O3

MOLECULAR WEIGHT :: 232.30

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 :: >2 gm/kg

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

REFERENCE :: EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 13,41,1978

Related Compounds

3-(1,4-dimethyl-1H-pyrazol-5-yl)-3-hydroxypropanoic acid
(2S)-2-amino-2-[(1S,5S)-6,6-dimethylbicyclo[3.1.1]heptan-2-yl]ethan-1-ol
5-(1-methyl-1H-indazol-3-yl)-1,3-oxazolidin-2-one
(2S)-2-[2-(methylsulfanyl)ethyl]oxirane
2-[1-(5-Methoxypyridin-2-yl)cyclopropyl]propan-2-amine
rac-(1R,3S)-3-(3-fluorophenyl)-2,2-dimethylcyclopropan-1-amine
2-methoxy-3-methyl-3-(1H-pyrazol-4-yl)butanoic acid
rac-(1R,3S)-2,2-dimethyl-3-(1-methyl-1H-pyrrol-2-yl)cyclopropan-1-amine
rac-[(1R,3R)-3-(5-methoxypyridin-2-yl)-2,2-dimethylcyclopropyl]methanamine
O-[2-(5-methoxypyridin-2-yl)-2-methylpropyl]hydroxylamine

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