4-n-Heptylbenzoic acid

Catalog Number	ACM38350877
CAS Number	38350-87-7
Structure
Synonyms	4-heptylbenzoic acid
IUPAC Name	4-heptylbenzoic acid
Molecular Weight	220.3
Molecular Formula	C14H20O2
Canonical SMILES	CCCCCCCC1=CC=C(C=C1)C(=O)O
InChI	InChI=1S/C14H20O2/c1-2-3-4-5-6-7-12-8-10-13(11-9-12)14(15)16/h8-11H,2-7H2,1H3,(H,15,16
InChI Key	VSUKEWPHURLYTK-UHFFFAOYSA-N
Boiling Point	345.2 ºC at 760mmHg
Melting Point	98 ºC
Purity	0.98
Density	1.013 g/ml
Appearance	White microcrystalline powder