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4'-Heptyl-4-biphenylcarbonitrile

Catalog Number
ACM41122718-2
Product Name
4'-Heptyl-4-biphenylcarbonitrile
Structure
CAS
41122-71-8
Category
Liquid Crystal (LC) Materials
IUPAC Name
4-(4-heptylphenyl)benzonitrile
Molecular Weight
277.4g/mol
Molecular Formula
C20H23N
Canonical SMILES
CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N
InChI
InChI=1S/C20H23N/c1-2-3-4-5-6-7-17-8-12-19(13-9-17)20-14-10-18(16-21)11-15-20/h8-15H,2-7H2,1H3
InChI Key
ZGOWXOZNUNZPAV-UHFFFAOYSA-N
Complexity
310
Covalently-Bonded Unit Count
1
EC Number
255-229-0
Exact Mass
277.18305g/mol
Formal Charge
0
Heavy Atom Count
21
MeSH Entry Terms
4-heptyl-4'-cyanobiphenyl;K21 cpd
Monoisotopic Mass
277.18305g/mol
Rotatable Bond Count
7
XLogP3
6.8
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