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4-Heptyloxy-[1,1'-biphenyl]-4'-carbonitrile

Catalog Number
ACM52364724-2
Product Name
4-Heptyloxy-[1,1'-biphenyl]-4'-carbonitrile
Structure
CAS
52364-72-4
Category
Liquid Crystal (LC) Materials
IUPAC Name
4-(4-heptoxyphenyl)benzonitrile
Molecular Weight
293.4g/mol
Molecular Formula
C20H23NO
Canonical SMILES
CCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N
InChI
InChI=1S/C20H23NO/c1-2-3-4-5-6-15-22-20-13-11-19(12-14-20)18-9-7-17(16-21)8-10-18/h7-14H,2-6,15H2,1H3
InChI Key
JPBFKTCKZLMJED-UHFFFAOYSA-N
Complexity
329
Covalently-Bonded Unit Count
1
EC Number
257-876-4
Exact Mass
293.177964g/mol
Formal Charge
0
Heavy Atom Count
22
Monoisotopic Mass
293.177964g/mol
Rotatable Bond Count
8
XLogP3
6.1
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