Pelargonic acid

CAS	112-05-0
Structure
Synonyms	1-Octanecarboxylic acid
IUPAC Name	Nonanoic acid
Molecular Weight	158.24
Canonical SMILES	CCCCCCCCC(=O)O
InChI	InChI=1S/C9H18O2/c1-2-3-4-5-6-7-8-9(10)11/h2-8H2,1H3,(H,10,11)
InChI Key	FBUKVWPVBMHYJY-UHFFFAOYSA-N
Boiling Point	268-269 °C
Melting Point	9 °C
Flash Point	212 °F
Purity	98%+
Density	0.906 g/mL at 25 °C(lit.)
Exact Mass	158.130679813
Monoisotopic Mass	158.130679813
Physical State	Liquid
Refractive Index	n20/D 1.432(lit.)
Storage Conditions	2-8 °C
Topological Polar Surface Area	37.3 Ų