Methyl (3aS,4S,7aS)-7-oxooctahydro-1H-indene-4-carboxylate
[CAS# 630103-79-6]

Identification

• Name: Methyl (3aS,4S,7aS)-7-oxooctahydro-1H-indene-4-carboxylate
• Synonyms: (3aS,4S,7aS)-methyl 7-oxooctahydro-1H-indene-4-carboxylate
• Molecular Formula: C₁₁H₁₆O₃
• Molecular Weight: 196.24
• CAS Registry Number: 630103-79-6
• SMILES: O=C(OC)[C@H]1CCC(=O)[C@H]2CCC[C@H]12
• InChI: 1S/C11H16O3/c1-14-11(13)9-5-6-10(12)8-4-2-3-7(8)9/h7-9H,2-6H2,1H3/t7-,8-,9-/m0/s1
• InChIKey: CFGGCOSKVNLVRA-CIUDSAMLSA-N

Properties

• Density: 1.123g/cm³ (Cal.)
• Boiling point: 289.935°C at 760 mmHg (Cal.)
• Flash point: 124.804°C (Cal.)
• Refractive index: 1.491 (Cal.)