5-Methyl-gamma-Oxo-2-Thiophenebutanoicacid
[CAS# 22988-52-9]

Identification

• Name: 5-Methyl-gamma-Oxo-2-Thiophenebutanoicacid
• Synonyms: 4-(5-Methyl-2-Thienyl)-4-Oxo-Butanoate; 4-(5-Methyl-2-Thienyl)-4-Oxobutanoate; 4-Keto-4-(5-Methyl-2-Thienyl)Butyrate
• Molecular Formula: C₉H₉O₃S
• Molecular Weight: 197.23
• CAS Registry Number: 22988-52-9
• SMILES: C1=C(SC(=C1)C)C(=O)CCC([O-])=O
• InChI: 1S/C9H10O3S/c1-6-2-4-8(13-6)7(10)3-5-9(11)12/h2,4H,3,5H2,1H3,(H,11,12)/p-1
• InChIKey: BBGWOJJYYCDOAN-UHFFFAOYSA-M

Properties

• Boiling point: 410.553°C at 760 mmHg (Cal.)
• Flash point: 202.095°C (Cal.)