Ethyl 3,4,5,6,7,8-Hexahydro-4,4-Dimethyl-2-Oxo-2H-1-Benzopyran-3-Carboxylate
[CAS# 94349-45-8]

Identification

• Name: Ethyl 3,4,5,6,7,8-Hexahydro-4,4-Dimethyl-2-Oxo-2H-1-Benzopyran-3-Carboxylate
• Synonyms: 4,4-Dimethyl-2-Oxo-5,6,7,8-Tetrahydro-3H-Chromene-3-Carboxylic Acid Ethyl Ester; 2-Keto-4,4-Dimethyl-5,6,7,8-Tetrahydro-3H-Chromene-3-Carboxylic Acid Ethyl Ester
• Molecular Formula: C₁₄H₂₀O₄
• Molecular Weight: 252.31
• CAS Registry Number: 94349-45-8
• EINECS: 305-162-9
• SMILES: C(OC(=O)C1C(C2=C(OC1=O)CCCC2)(C)C)C
• InChI: 1S/C14H20O4/c1-4-17-12(15)11-13(16)18-10-8-6-5-7-9(10)14(11,2)3/h11H,4-8H2,1-3H3
• InChIKey: AVEWKITZFFDLLF-UHFFFAOYSA-N

Properties

• Density: 1.133g/cm³ (Cal.)
• Boiling point: 369.243°C at 760 mmHg (Cal.)
• Flash point: 182.266°C (Cal.)