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M31503

α-Methylbenzyl cyanide

96%

Synonym(s):

α-Methylphenylacetonitrile

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About This Item

Linear Formula:
C6H5CH(CH3)CN
CAS Number:
1823-91-2
Molecular Weight:
131.17
NACRES:
NA.22
PubChem Substance ID:
24896801
UNSPSC Code:
12352100
EC Number:
217-354-9
MDL number:
MFCD00001871
Assay:
96%
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Quality Level

100

assay

96%

refractive index

n20/D 1.5106 (lit.)

density

0.985 g/mL at 25 °C (lit.)

SMILES string

CC(C#N)c1ccccc1

InChI

1S/C9H9N/c1-8(7-10)9-5-3-2-4-6-9/h2-6,8H,1H3

InChI key

NVAOLENBKNECGF-UHFFFAOYSA-N

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

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

wgk

WGK 3

flash_point_f

201.2 °F - closed cup

flash_point_c

94 °C - closed cup

ppe

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

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
MKCV0241
MKCJ0245
MKCC0706
MKBR5496V
MKBR1976V

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Zhong-Liu Wu et al.
Biotechnology and applied biochemistry, 35(Pt 1), 61-67 (2002-02-09)
Racemic 2-phenylpropionitrile was resolved enantioselectively by nitrile-converting enzymes in cells of Rhodococcus sp. CGMCC 0497 to S-(+)-2-phenylpropionic acid and R-(-)-2-phenylpropionamide. By optimization of the culture conditions, great enhancement of enzyme activity and enantioselectivity was achieved. Furthermore, the relationship between cell-growth
Ondřej Kaplan et al.
BMC biotechnology, 11, 2-2 (2011-01-08)
Nitrilases attract increasing attention due to their utility in the mild hydrolysis of nitriles. According to activity and gene screening, filamentous fungi are a rich source of nitrilases distinct in evolution from their widely examined bacterial counterparts. However, fungal nitrilases
Tamás Plaszkó et al.
Metabolites, 10(11) (2020-11-12)
The interaction between plant defensive metabolites and different plant-associated fungal species is of high interest to many disciplines. Volatile organic compounds (VOCs) are natural products that are easily evaporated under ambient conditions. They play a very important role in inter-species
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Global Trade Item Number

SKUGTIN
M31503-25G04061836824716