trans-2-(4-Cyanophenyl)-5-n-propyl-1,3-dioxane

Catalog Number	ACM80285161-1
CAS Number	80285-16-1
Structure
Synonyms	4-(5-Propyl-1,3-dioxan-2-yl)benzonitrile
IUPAC Name	4-(5-propyl-1,3-dioxan-2-yl)benzonitrile
Molecular Weight	231.29
Molecular Formula	C14H17NO2
Canonical SMILES	CCCC1COC(OC1)C2=CC=C(C=C2)C#N
InChI	InChI=1S/C14H17NO2/c1-2-3-12-9-16-14(17-10-12)13-6-4-11(8-15)5-7-13/h4-7,12,14H,2-3,9-10H2,1H3
InChI Key	GQPFCPRCGONDNN-UHFFFAOYSA-N
Melting Point	58-60 ºC
Purity	99.5%+