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3-Acetylbenzonitrile

Name: 3-Acetylbenzonitrile
Brand: ALDRICH

97%

Synonym(s):

3′-Cyanoacetophenone

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About This Item

Linear Formula:

CH₃COC₆H₄CN

CAS Number:

6136-68-1

Molecular Weight:

145.16

NACRES:

NA.22

PubChem Substance ID:

24857570

UNSPSC Code:

12352100

EC Number:

228-110-6

MDL number:

MFCD00001806

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Properties

assay

97%

mp

98-100 °C (lit.)

SMILES string

CC(=O)c1cccc(c1)C#N

InChI

1S/C9H7NO/c1-7(11)9-4-2-3-8(5-9)6-10/h2-5H,1H3

InChI key

SBCFGFDAZCTSRH-UHFFFAOYSA-N

Description

Application

3-Acetylbenzonitrile has been used in the preparation of:

3-(hydroxyacetyl)benzonitrile
3-(1-(3-(4-(pyridin-3-yl)pyrimidin-2-ylamino)-4-methylphenylimino)ethyl)benzonitrile

pictograms

GHS07

signalword

Warning

hcodes

H302 + H312 + H332,H315,H319,H335

pcodes

P261 - P280 - P301 + P312 - P302 + P352 + P312 - P304 + P340 + P312 - P305 + P351 + P338

Hazard Classifications

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

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

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