2-Methyl-2-pentenoic acid

CAS	3142-72-1 / 16957-70-3
Structure
Synonyms	Trans-2-methyl-2-pentenoic acid
IUPAC Name	(E)-2-Methylpent-2-enoic acid
Molecular Weight	114.14
Canonical SMILES	CCC=C(C)C(=O)O
InChI	InChI=1S/C6H10O2/c1-3-4-5(2)6(7)8/h4H,3H2,1-2H3,(H,7,8)/b5-4+
InChI Key	JJYWRQLLQAKNAD-SNAWJCMRSA-N
Boiling Point	123-125 °C
Melting Point	26-28 °C
Flash Point	226 °F
Purity	95%+
Density	0.979 g/mL at 25 °C
Exact Mass	114.068079557
Isomeric SMILES	CC/C=C(\C)/C(=O)O
Monoisotopic Mass	114.068079557
Physical State	Liquid
Refractive Index	n20/D 1.46(lit.)
Storage Conditions	Dry place,Room Temperature
Topological Polar Surface Area	37.3 Ų