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Safrole

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Safrole / CAS : 94-59-7

Appearance Transparent to yellowish oily liquid UN 3082 9/PG 3
HS 2909309090 DG Class -
Synonyms 5-Allyl-1,3-Benzodioxole; Safrol; Shikimole; Shikomol; Safrene; Sassafras; Rhyuno oil; Safrole MF; 1,3-Benzodioxole, 5-(2-Propenyl)-; Allylcatechol Methylene Ether; Shikimol; 5-(2-Propenyl)-1,3-Benzodioxole; m-Allylpyrocatechin Methylene Ether; Allylpyrocatechol Methylene Ether; 4-Allylpyrocatechol Formaldehyde Acetal; 3,4-(Methylenedioxy)Allylbenzene; 4-Allyl-1,2-Methylenedioxybenzene; Allyldioxybenzene Methylene Ether; 1,2-Methylenedioxy-4-Allylbenzene; 1-Allyl-3,4-Methylenedioxybenzene; 1,3-Benzodioxole, 5-Allyl-; 5-prop-2-enyl-1,3-Benzodioxole; Benzene, 4-Allyl-1,2-(Methylenedioxy)-; CH2O2C6H3CH2CH=CH2
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Properties

Summary

Formula
C10H10O2
Molecular Mass
162.18500
Exact Mass
162.06800
PSA
18.46000
Logp
2.14380
IUPAC
5-prop-2-enyl-1,3-benzodioxole
SMILES
C=CCC1=CC2=C(C=C1)OCO2

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Intermediates
Flavors and Fragrances > Essence
Organic Chemical Materials > Aromatic Compounds

Chemical and Physical Properties

Melting Point
11.2 °C(lit.)
Density
1.099 g/mL at 20 °C
Boiling Point
232-234 °C(lit.)
Flash Point
208 °F
Appearance
Transparent to yellowish oily liquid

Export information

HS Code
2909309090
Export Rebate
13%
UN No.
3082 9/PG 3
Risk Code
R22; R45; R68
Safety Label
T

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