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ChemicalBook--->CAS DataBase List--->4439-02-5

4439-02-5

4439-02-5 Structure

4439-02-5 Structure
IdentificationMore
[Name]

3,4-(Methylenedioxy)phenylacetonitrile
[CAS]

4439-02-5
[Synonyms]

1,3-BENZODIOXOLE-5-ACETONITRILE
3,4-METHYLENEDIOXYBENZYL CYANIDE
3,4-(METHYLENEDIOXY)PHENYLACETONITRILE
A-CYANO-3,4-METHYLENEDIOXYTOLUENE
PIPERONYL CYANIDE
1,3-Benzodioxol-5-ylacetonitrile
(1,3-Benzodioxol-5-yl)acetonitrile~3,4-(Methylenedioxy)benzyl cyanide~Piperonyl cyanide
Homopiperonylnitrile
3,4-METHYLENEDIOXYPHENYLACETONITRILE, 99 %
PEPERACETONITRILE
Homopiperonylonitrile
3,4-METHYLENEDIOXYPHENYLACETONITRILE 99%
3,4-(Methylenedioxy)phenylacetonitrile, 98+%
1,3-Benzodioxole-5-acetonitrile, Homopiperonylnitrile
2-(1,3-Benzodioxol-5-yl)acetonitrile
2-(1,3-Benzodioxole-5-yl)acetonitrile
[EINECS(EC#)]

224-655-9
[Molecular Formula]

C9H7NO2
[MDL Number]

MFCD00005835
[Molecular Weight]

161.16
[MOL File]

4439-02-5.mol
Chemical PropertiesBack Directory
[Appearance]

Pale yellow low melting solid
[Melting point ]

43-45 °C(lit.)
[Boiling point ]

135-140°C 5mm
[density ]

1.270±0.06 g/cm3(Predicted)
[Fp ]

>230 °F
[storage temp. ]

Inert atmosphere,Room Temperature
[Water Solubility ]

Insoluble in water.
[BRN ]

7739
[InChIKey]

ZQPBOYASBNAXOZ-UHFFFAOYSA-N
[CAS DataBase Reference]

4439-02-5(CAS DataBase Reference)
[NIST Chemistry Reference]

3,4-Methylenedioxyphenylacetonitrile(4439-02-5)
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

S36:Wear suitable protective clothing .
S36/37:Wear suitable protective clothing and gloves .
[RIDADR ]

3439
[WGK Germany ]

3
[HazardClass ]

6.1
[PackingGroup ]

III
[HS Code ]

29329990
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Dimethyl sulfoxide-->Sodium cyanide-->Catechol-->Dichloroethane-->1,3-Benzodioxole-->1,3,5-trioxane
[Preparation Products]

Homopiperonylamine-->Homopiperonylamide-->(3,4-DIHYDROXYPHENYL)ACETONITRILE-->2-(Benzo[d][1,3]dioxol-5-yl)-3-oxobutanenitrile
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

1,3-Benzodioxole-5-acetonitrile(4439-02-5).msds
Hazard InformationBack Directory
[Chemical Properties]

Pale yellow low melting solid
[Uses]

3,4-(Methylenedioxy)phenylacetonitrile was used in synthesis of derrubone. It was used as standard to analyze the seized methamphetamine samples showing unique profiles of stable isotopic compositions by isotope ratio mass spectrometry.
[General Description]

3,4-(Methylenedioxy)phenylacetonitrile undergoes hydrolysis catalyzed by nitrilase ZmNIT2 enzyme from maize.
Spectrum DetailBack Directory
[Spectrum Detail]

3,4-(Methylenedioxy)phenylacetonitrile(4439-02-5)MS
3,4-(Methylenedioxy)phenylacetonitrile(4439-02-5)1HNMR
3,4-(Methylenedioxy)phenylacetonitrile(4439-02-5)13CNMR
3,4-(Methylenedioxy)phenylacetonitrile(4439-02-5)IR1
3,4-(Methylenedioxy)phenylacetonitrile(4439-02-5)IR2
3,4-(Methylenedioxy)phenylacetonitrile(4439-02-5)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3,4-(Methylenedioxy)phenylacetonitrile, 98%(4439-02-5)
[Alfa Aesar]

3,4-(Methylenedioxy)phenylacetonitrile, 98+%(4439-02-5)
[Sigma Aldrich]

4439-02-5(sigmaaldrich)
[TCI AMERICA]

3,4-Methylenedioxyphenylacetonitrile,>98.0%(GC)(4439-02-5)
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Tags:4439-02-5 Related Product Information
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