Decyl butyrate

Catalog	ACM5454091-1
CAS	5454-09-1
Synonyms	Butanoic acid, decyl ester
IUPAC Name	Decyl butanoate
Molecular Weight	228.37
Molecular Formula	C14H28O2
Canonical SMILES	CCCCCCCCCCOC(=O)CCC
InChI	InChI=1S/C14H28O2/c1-3-5-6-7-8-9-10-11-13-16-14(15)12-4-2/h3-13H2,1-2H3
InChI Key	PUCQHFICPFUPKW-UHFFFAOYSA-N
Boiling Point	134-135 °C
Melting Point	-46 °C
Flash Point	>230 °F
Purity	95%+
Density	0.862 g/mL at 25 °C(lit.)
Exact Mass	228.208930132
Monoisotopic Mass	228.208930132
Physical State	Oily liquid
Refractive Index	n20/D 1.431(lit.)
Topological Polar Surface Area	26.3 Ų