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Isosafrole Properties

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Isosafrole

Molecule 3D Structure Image

Molecule Structure Image

Description
Isosafrole is a phenylpropene, a type of aromatic organic chemical with a smell similar to anise or licorice. It is found in small amounts in various essential oils, but is most commonly obtained by isomerizing the plant oil safrole. It is a precursor for MDP2P which is converted into the psychoactive drug MDMA.

Chemical Properties

Appearance	Clear to pale yellow oily liquid
Boiling Point	77-86 °C
CAS Number	120-58-1
Density	1.12 g/ml
EINECS Number	204-410-2
IUPAC Name	(E)-5-(Prop-1-enyl)benzo[d][1,3]dioxole
InChI	1S/C10H10O2/c1-2-3-8-4-5-9-10(6-8)12-7-11-9/h2-6H,7H2,1H3/b3-2+
InChIKey	VHVOLFRBFDOUSH-NSCUHMNNSA-N
Molar Mass	162.188 g/mol
Molecular Formula	C₁₀H₁₀O₂
RTECS Number	DA5950000
Refractive	n20/D 1.573
Synonyms	5-(1-Propenyl)-1,3-benzodioxole;3,4-Methylenedioxyphenyl-1-propene;Isosafrole;1,3-Benzodioxole,5-(1-propen-1-yl)-

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