4-Cyanophenyl4-Butylbenzoate

Catalog Number	ACM38690776-1
CAS Number	38690-77-6
Structure
Synonyms	BenzoicAcid,4-Butyl-,4-CyanophenylEster
IUPAC Name	(4-cyanophenyl)4-butylbenzoate
Molecular Weight	279.3
Molecular Formula	C18H17NO2
Canonical SMILES	CCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C#N
InChI	InChI=1S/C18H17NO2/c1-2-3-4-14-5-9-16(10-6-14)18(20)21-17-11-7-15(13-19)8-12-17/h5-12H,2-4H2,1H3
InChI Key	XQRFASOUJIKXRE-UHFFFAOYSA-N
Melting Point	67-69 ºC
Purity	99%+