4-(5-Pentyl-1,3-Dioxan-2-Yl)Benzonitrile

Catalog Number	ACM74800627-1
CAS Number	74800-62-7
Structure
Synonyms	2-(4-Cyanophenyl)-5-N-Pentyl-1,3-Dioxane
IUPAC Name	4-(5-pentyl-1,3-dioxan-2-yl)benzonitrile
Molecular Weight	259.34
Molecular Formula	C16H21NO2
Canonical SMILES	CCCCCC1COC(OC1)C2=CC=C(C=C2)C#N
InChI	InChI=1S/C16H21NO2/c1-2-3-4-5-14-11-18-16(19-12-14)15-8-6-13(10-17)7-9-15/h6-9,14,16H,2-5,11-12H2,1H3
InChI Key	SSXIKUCDZOQOKB-UHFFFAOYSA-N
Melting Point	56-58 ºC
Purity	95%+