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Benzonitrile,4-(trans-4-heptylcyclohexyl)-

Catalog Number ACM61204033-1
CAS Number 61204-03-3
Structure
Synonyms 4-(4α-Heptylcyclohexane-1β-yl)benzonitrile
IUPAC Name 4-(4-heptylcyclohexyl)benzonitrile
Molecular Weight 283.5
Molecular Formula C20H29N
Canonical SMILES CCCCCCCC1CCC(CC1)C2=CC=C(C=C2)C#N
InChI InChI=1S/C20H29N/c1-2-3-4-5-6-7-17-8-12-19(13-9-17)20-14-10-18(16-21)11-15-20/h10-11,14-15,17,19H,2-9,12-13H2,1H3
InChI Key NSGMZTNTQKRAFA-UHFFFAOYSA-N
Boiling Point 409.2±24.0 ºC
Melting Point 33 ºC
Purity 99%+
Density 0.96±0.1 g/ml