4-Cyanophenyl 4-Heptylbenzoate

Catalog Number	ACM38690765
CAS Number	38690-76-5
Synonyms	4-Heptylbenzoic Acid 4-Cyanophenyl Ester
IUPAC Name	(4-cyanophenyl) 4-heptylbenzoate
Molecular Weight	321.42
Molecular Formula	C21H23NO2
Canonical SMILES	CCCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C#N
InChI	InChI=1S/C21H23NO2/c1-2-3-4-5-6-7-17-8-12-19(13-9-17)21(23)24-20-14-10-18(16-22)11-15-20/h8-15H,2-7H2,1H3
InChI Key	ZWAUTNYPKHVAEZ-UHFFFAOYSA-N
Melting Point	57 ºC
Purity	98%+
Appearance	White to Light yellow powder to crystal