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171573

3-Phenylpropionitrile

Name: 3-Phenylpropionitrile
Brand: ALDRICH

99%

Synonym(s):

Hydrocinnamonitrile

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About This Item

Linear Formula:

C₆H₅CH₂CH₂CN

CAS Number:

645-59-0

Molecular Weight:

131.17

UNSPSC Code:

12352100

NACRES:

NA.22

PubChem Substance ID:

24850382

EC Number:

211-447-8

Beilstein/REAXYS Number:

636348

MDL number:

MFCD00001961

Assay:

99%

Form:

liquid

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Properties

Quality Level

100

assay

99%

form

liquid

refractive index

n20/D 1.521 (lit.)

bp

113 °C/9 mmHg (lit.)

mp

−2-−1 °C (lit.)

density

1.001 g/mL at 25 °C (lit.)

functional group

nitrile, phenyl

SMILES string

N#CCCc1ccccc1

InChI

1S/C9H9N/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7H2

InChI key

ACRWYXSKEHUQDB-UHFFFAOYSA-N

Description

General description

The effect of 3-Phenylpropionitrile on the growth and survival of woodlouse Porcellio scaber has been studied.

Application

3-Phenylpropionitrile was used to study the free enzyme activity of nitrilase AtNIT1.

pictograms

GHS06

signalword

Danger

hcodes

H301

pcodes

P264 - P270 - P301 + P310 - P405 - P501

Hazard Classifications

Acute Tox. 3 Oral

Storage Class

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

wgk

WGK 3

flash_point_f

230.0 °F - closed cup

flash_point_c

110 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

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Biological Effects of Glucosinolate Degradation Products from Horseradish: A Horse that Wins the Race.

Marijana Popović et al.

Biomolecules, 10(2) (2020-02-27)

Horseradish degradation products, mainly isothiocyanates (ITC) and nitriles, along with their precursors glucosinolates, were characterized by GC-MS and UHPLC-MS/MS, respectively. Volatiles from horseradish leaves and roots were isolated using microwave assisted-distillation (MAD), microwave hydrodiffusion and gravity (MHG) and hydrodistillation (HD).

Selective hydrolysis of the nitrile group of cis-dihydrodiols from aromatic nitriles.

Journal of Molecular Catalysis. B, Enzymatic, 38(2), 78-83 (2006)

Methyl Jasmonate Treatment of Broccoli Enhanced Glucosinolate Concentration, Which Was Retained after Boiling, Steaming, or Microwaving.

Yu-Chun Chiu et al.

Foods (Basel, Switzerland), 9(6) (2020-06-12)

Exogenous methyl jasmonate (MeJA) treatment was known to increase the levels of neoglucobrassicin and their bioactive hydrolysis products in broccoli (Brassica oleracea var. italica), but the fate of MeJA-induced glucosinolates (GSLs) after various cooking methods was unknown. This study measured

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Global Trade Item Number

SKU	GTIN
171573-10G	04061836817329