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132330

p-Tolunitrile

98%

Synonym(s):

4-Methylbenzonitrile

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About This Item

Linear Formula:
CH3C6H4CN
CAS Number:
104-85-8
Molecular Weight:
117.15
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
24848050
EC Number:
203-244-8
Beilstein/REAXYS Number:
507386
MDL number:
MFCD00001827
Assay:
98%
Form:
solid
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Quality Segment

assay

98%

form

solid

bp

103-106 °C/20 mmHg (lit.), 217 °C (lit.)

mp

26-28 °C (lit.)

solubility

alcohol: very soluble, diethyl ether: very soluble, water: insoluble

density

0.981 g/mL at 25 °C (lit.)

functional group

nitrile

SMILES string

Cc1ccc(cc1)C#N

InChI

1S/C8H7N/c1-7-2-4-8(6-9)5-3-7/h2-5H,1H3

InChI key

VCZNNAKNUVJVGX-UHFFFAOYSA-N

Pictograms

Health hazardExclamation mark
GHS08,GHS07

Signal Word

Danger

Hazard Classifications

Eye Irrit. 2 - Resp. Sens. 1 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class

11 - Combustible Solids

WGK

WGK 2

PPE (personal protective equipment)

dust mask type N95 (US), Eyeshields, Faceshields, Gloves

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