Methylamylacetic acid

CAS	1188-02-9
Structure
IUPAC Name	2-Methylheptanoic acid
Molecular Weight	144.21
Canonical SMILES	CCCCCC(C)C(=O)O
InChI	InChI=1S/C8H16O2/c1-3-4-5-6-7(2)8(9)10/h7H,3-6H2,1-2H3,(H,9,10)
InChI Key	NKBWMBRPILTCRD-UHFFFAOYSA-N
Boiling Point	140 °C
Flash Point	>230 °F
Purity	98%+
Density	0.906 g/mL at 25 °C(lit.)
Exact Mass	144.115029749
Monoisotopic Mass	144.115029749
Physical State	Oily liquid
Refractive Index	n20/D 1.425(lit.)
Storage Conditions	Below +30 °C
Topological Polar Surface Area	37.3 Ų