2-Ethyl-5-hydroxy-4-methyl-2-(2-methyl-1,3-butadien-1-yl)-3(2H)-thiophenone
[CAS# 95261-51-1]

Identification

• Name: 2-Ethyl-5-hydroxy-4-methyl-2-(2-methyl-1,3-butadien-1-yl)-3(2H)-thiophenone
• Synonyms: 2(5H)-Thiophenone, 5-ethyl-4-hydroxy-3-methyl-5-(2-methyl-1,3-butadienyl)-; 834-B1; Antibiotic 834-B1
• Molecular Formula: C₁₂H₁₆O₂S
• Molecular Weight: 224.32
• CAS Registry Number: 95261-51-1
• SMILES: O=C1\C(=C(\O)SC1(C=C(\C=C)C)CC)C
• InChI: 1S/C12H16O2S/c1-5-8(3)7-12(6-2)10(13)9(4)11(14)15-12/h5,7,14H,1,6H2,2-4H3
• InChIKey: BOMAALMZZQMZOS-UHFFFAOYSA-N

Properties

• Density: 1.176g/cm³ (Cal.)
• Boiling point: 334.374°C at 760 mmHg (Cal.)
• Flash point: 156.024°C (Cal.)