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94-59-7

94-59-7 Structure

94-59-7 Structure
IdentificationMore
[Name]

Safrole
[CAS]

94-59-7
[Synonyms]

1-ALLYL-3,4-METHYLIDENEDIOXYBENZENE
3-[3,4-(METHYLENEDIOXY)PHENYL]-1-PROPENE
3,4-METHYLENEDIOXYALLYLBENZENE
4-ALLYL-1,2-METHYLENEDIOXYBENZENE
5-(2-PROPENYL)-1,3-BENZODIOXOLE
5-ALLYL-1,3-BENZODIOXOLE
ALLYLDIOXYBENZENE METHYLENE ETHER
M-ALLYLPYROCATECHIN METHYLENE ETHER
SAFROL
SAFROLE
(1,2-(Methylenedioxy)-4-allyl)benzene
1,2-methylenedioxy-4-allyl-benzen
1,2-methylenedioxy-4-allylbenzene
1,3-Benzodioxole, 5-allyl-
1,3-Benzodioxole,5-(2-propenyl)-
1-Allyl-3,4-(methylenedioxy)benzene
1-allyl-3,4-methylenedioxybenzene
3-(3,4-Methylenedioxyphenyl)prop-1-ene
3,4-Methylenedioxy-allybenzene
3-Benzodioxole,5-(2-propenyl)-1
[EINECS(EC#)]

202-345-4
[Molecular Formula]

C10H10O2
[MDL Number]

MFCD00005841
[Molecular Weight]

162.19
[MOL File]

94-59-7.mol
Chemical PropertiesBack Directory
[Appearance]

light yellow-green liquid
[mp ]

11.2 °C(lit.)
[bp ]

232-234 °C(lit.)
[density ]

1.099 g/mL at 20 °C
[vapor pressure ]

1 mm Hg ( 63.8 °C)
[refractive index ]

n20/D 1.537(lit.)
[Fp ]

208 °F
[color ]

yellow
[Stability:]

Stable. Combustible. Incompatible with strong oxidizing agents.
[Water Solubility ]

insoluble, <0.1 g/100 mL at 18 ºC
[Merck ]

13,8395
[CAS DataBase Reference]

94-59-7(CAS DataBase Reference)
[NIST Chemistry Reference]

1,3-Benzodioxole, 5-(2-propenyl)-(94-59-7)
[EPA Substance Registry System]

94-59-7(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

T
[Risk Statements ]

R45:May cause cancer.
R22:Harmful if swallowed.
R68:Possible risk of irreversible effects.
[Safety Statements ]

S53:Avoid exposure - obtain special instruction before use .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
[RIDADR ]

UN 3082 9/PG 3
[WGK Germany ]

3
[RTECS ]

CY2800000
[Hazardous Substances Data]

94-59-7(Hazardous Substances Data)
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Sassafras oil
[Preparation Products]

Vanillin-->Ethyl vanillin-->Piperonyl aldehyde-->ISOEUGENOL-->BERBERINE CHLORIDE-->ISOSAFROLE-->Piperonyl butoxide-->2-AMINO-2-METHYL-(3-(3,4-METHYLENEDIOXYPHENYL))PROPANAMIDE
Hazard InformationBack Directory
[General Description]

Clear colorless or slightly yellow liquid with the odor of sassafras. Denser than water (density 1.09 g / cm3) and insoluble in water. Hence sinks in water. Obtained from oil of sassafras or oil of camphor.
[Reactivity Profile]

SAFROLE(94-59-7), an acetal, is readily hydrolyzed in acidic solution to give 4-allylpyrocatechol and formaldehyde (or formaldehyde polymers).
[Air & Water Reactions]

Insoluble in water.
[Fire Hazard]

This chemical is combustible.
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

5-Allyl-1,3-benzodioxole(94-59-7).msds
Spectrum DetailBack Directory
[Spectrum Detail]

Safrole(94-59-7)1HNMR
Safrole(94-59-7)MS
Safrole(94-59-7)IR2
Safrole(94-59-7)13CNMR
Safrole(94-59-7)IR1
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Safrole,97%(94-59-7)
[Sigma Aldrich]

94-59-7(sigmaaldrich)
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