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3,4-(Methylenedioxy)phenylacetonitrile

ALDRICH/145300 - 99%

Synonym: 1,3-Benzodioxole-5-acetonitrile; Homopiperonylnitrile

CAS Number: 4439-02-5
Empirical Formula (Hill Notation): C9H7NO2
Molecular Weight: 161.16
EC Number: 224-655-9
MDL Number: MFCD00005835
Linear Formula: C9H7NO2
Product Type: Chemical
Catalog Number PKG Qty. Price Quantity
45-145300-10G 10 g
 $107.00
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assay 99%
InChI 1S/C9H7NO2/c10-4-3-7-1-2-8-9(5-7)12-6-11-8/h1-2,5H,3,6H2
InChI key ZQPBOYASBNAXOZ-UHFFFAOYSA-N
mp 43-45 °C (lit.)
Quality Level 100 
SMILES string N#CCc1ccc2OCOc2c1
Application: 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.
Packaging: 10, 50 g in glass bottle
Purity 99%
mp 43-45 °C (lit.)
UNSPSC 12352100

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