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4'-Octyl-4-biphenylcarbonitrile

Catalog Number
ACM52709849-4
Product Name
4'-Octyl-4-biphenylcarbonitrile
Structure
CAS
52709-84-9
Category
Liquid Crystal (LC) Materials
IUPAC Name
4-(4-octylphenyl)benzonitrile
Molecular Weight
291.4g/mol
Molecular Formula
C21H25N
SMILES
CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N
InChI
InChI=1S/C21H25N/c1-2-3-4-5-6-7-8-18-9-13-20(14-10-18)21-15-11-19(17-22)12-16-21/h9-16H,2-8H2,1H3
InChIKey
CSQPODPWWMOTIY-UHFFFAOYSA-N
EC Number
258-120-6
Status
0
Complexity
323
Formal Charge
0
Exact Mass
291.1987g/mol
Monoisotopic Mass
291.1987g/mol
XLogP3
7.3
MeSH Entry Terms
4'-octyl-4-cyanobiphenyl;4-n-octyl-4'-cyanobiphenyl
Covalently-Bonded Unit Count
1
Heavy Atom Count
22
Rotatable Bond Count
8
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