7alpha-Methyl-5-Oxo-2,3,5,6,7,7alpha-Hexahydro-1H-Indene-4-Carboxylic Acid
[CAS# 13349-21-8]

Identification

• Name: 7alpha-Methyl-5-Oxo-2,3,5,6,7,7alpha-Hexahydro-1H-Indene-4-Carboxylic Acid
• Synonyms: 4-Indancarboxylic acid, 5,6,7,7a-tetrahydro-7a-methyl-5-oxo-; 7a-Methyl-5-oxo-2,3,5,6,7,7a-hexahydro-1H-indene-4-carboxylic acid; 7a-Methyl-5-oxo-2,3,5,6,7,7a-hexahydro-1H-indene-4-carboxylic acid #
• Molecular Formula: C₁₁H₁₄O₃
• Molecular Weight: 194.23
• CAS Registry Number: 13349-21-8
• SMILES: O=C(O)C\2=C1/CCCC1(CCC/2=O)C
• InChI: 1S/C11H14O3/c1-11-5-2-3-7(11)9(10(13)14)8(12)4-6-11/h2-6H2,1H3,(H,13,14)
• InChIKey: INMQROHCSVXGGA-UHFFFAOYSA-N

Properties

• Density: 1.228g/cm³ (Cal.)
• Boiling point: 366.036°C at 760 mmHg (Cal.)
• Flash point: 189.357°C (Cal.)
• Refractive index: 1.547 (Cal.)