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4'-Pentyl-4-biphenylcarbonitrile

Catalog Number
ACM40817081-2
Product Name
4'-Pentyl-4-biphenylcarbonitrile
Structure
CAS
40817-08-1
Category
Liquid Crystal (LC) Materials
IUPAC Name
4-(4-pentylphenyl)benzonitrile
Molecular Weight
249.3g/mol
Molecular Formula
C18H19N
SMILES
CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N
InChI
InChI=1S/C18H19N/c1-2-3-4-5-15-6-10-17(11-7-15)18-12-8-16(14-19)9-13-18/h6-13H,2-5H2,1H3
InChIKey
HHPCNRKYVYWYAU-UHFFFAOYSA-N
EC Number
255-093-2
Status
0
Complexity
284
Formal Charge
0
Exact Mass
249.15175g/mol
Monoisotopic Mass
249.15175g/mol
XLogP3
5.4
MeSH Entry Terms
4-cyano-4'-pentylbiphenyl;4-n-pentyl-4'-cyanobiphenyl
Covalently-Bonded Unit Count
1
Heavy Atom Count
19
Rotatable Bond Count
5
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