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4'-Heptylbiphenyl-4-carboxylic acid 4'-cyanobiphenyl-4-yl ester

Catalog Number ACM72928304-1
CAS Number 72928-30-4
Synonyms 4'-Cyano[1,1'-biphenyl]-4-yl 4'-heptyl[1,1'-biphenyl]-4-carboxylate
IUPAC Name [4-(4-cyanophenyl)phenyl] 4-(4-heptylphenyl)benzoate
Molecular Weight 473.6
Molecular Formula C33H31NO2
Canonical SMILES CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C#N
InChI InChI=1S/C33H31NO2/c1-2-3-4-5-6-7-25-8-12-27(13-9-25)29-16-18-31(19-17-29)33(35)36-32-22-20-30(21-23-32)28-14-10-26(24-34)11-15-28/h8-23H,2-7H2,1H3
InChI Key YTSKNVPWUIOPIL-UHFFFAOYSA-N
Purity 99%+