CAS
39718-00-8 Purity
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39718-00-8 Purity
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2,6-Dimethylbenzonitrile
CAS
6575-13-9
Catalog Number
ACM6575139
Category
Solvents
Molecular Weight
131.18
Molecular Formula
C9H9N
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Specification
Synonyms
2,6-dimethylbenzonitrile
IUPAC Name
2,6-dimethylbenzonitrile
Canonical SMILES
CC1=CC=CC(C)=C1C#N
InChI
1S/C9H9N/c1-7-4-3-5-8(2)9(7)6-10/h3-5H,1-2H3
InChI Key
QSACPWSIIRFHHR-UHFFFAOYSA-N
Boiling Point
228.7±9.0 °C at 760 mmHg
Melting Point
88-91 °C
Flash Point
91.9±11.2 °C
Density
1.0±0.1 g/cm3
Assay
≥96.0%
Color
White to cream
EC Number
229-503-5
Exact Mass
131.073502
Form
Crystals or powder or crystalline powder
Hazard Codes
Xn:Harmful;
LogP
2.58
MDL Number
MFCD00037166
PSA
23.79
Refractive Index
1.526
Vapor Pressure
0.1±0.5 mmHg at 25°C
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