3-Formylbut-2-Endiyl Diacetate
[CAS# 85030-54-2]

Identification

• Name: 3-Formylbut-2-Endiyl Diacetate
• Synonyms: [(E)-3-Methyl-4-Oxo-But-2-Enyl] Acetate Acetate; Acetic Acid [(E)-3-Methyl-4-Oxobut-2-Enyl] Ester Acetate; Acetic Acid [(E)-4-Keto-3-Methyl-But-2-Enyl] Ester Acetate
• Molecular Formula: C₉H₁₃O₅
• Molecular Weight: 201.20
• CAS Registry Number: 85030-54-2
• EINECS: 285-180-0
• SMILES: C(OC(=O)C)\C=C(/C)C=O.CC([O-])=O
• InChI: 1S/C7H10O3.C2H4O2/c1-6(5-8)3-4-10-7(2)9;1-2(3)4/h3,5H,4H2,1-2H3;1H3,(H,3,4)/p-1/b6-3+
• InChIKey: JGWDYCXIWONDLQ-ZIKNSQGESA-M

Properties

• Boiling point: 371.6°C at 760 mmHg (Cal.)
• Flash point: 144.9°C (Cal.)