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HomeProduct name list3,4-(Methylenedioxy)phenylacetonitrile

3,4-(Methylenedioxy)phenylacetonitrile

Synonym(s):1,3-Benzodioxole-5-acetonitrile;Homopiperonylnitrile

  • CAS NO.:4439-02-5
  • Empirical Formula: C9H7NO2
  • Molecular Weight: 161.16
  • MDL number: MFCD00005835
  • EINECS: 224-655-9
  • SAFETY DATA SHEET (SDS)
  • Update Date: 2024-11-20 15:18:15
3,4-(Methylenedioxy)phenylacetonitrile Structural

What is 3,4-(Methylenedioxy)phenylacetonitrile?

Chemical properties

Pale yellow low melting solid

The Uses of 3,4-(Methylenedioxy)phenylacetonitrile

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.

Properties of 3,4-(Methylenedioxy)phenylacetonitrile

Melting point: 43-45 °C(lit.)
Boiling point: 135-140°C 5mm
Density  1.270±0.06 g/cm3(Predicted)
Flash point: >230 °F
storage temp.  Inert atmosphere,Room Temperature
form  powder to crystal
color  White to Light yellow
Water Solubility  Insoluble in water.
BRN  7739
Exposure limits NIOSH: IDLH 25 mg/m3
CAS DataBase Reference 4439-02-5(CAS DataBase Reference)
NIST Chemistry Reference 3,4-Methylenedioxyphenylacetonitrile(4439-02-5)

Safety information for 3,4-(Methylenedioxy)phenylacetonitrile

Signal word Warning
Pictogram(s)
ghs
Exclamation Mark
Irritant
GHS07
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.

Computed Descriptors for 3,4-(Methylenedioxy)phenylacetonitrile

InChIKey ZQPBOYASBNAXOZ-UHFFFAOYSA-N

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