Methyl (3aR,6aR)-3-methylene-4-oxohexahydro-3a(1H)-pentalenecarboxylate
[CAS# 688799-51-1]

Identification

• Name: Methyl (3aR,6aR)-3-methylene-4-oxohexahydro-3a(1H)-pentalenecarboxylate
• Synonyms: (3aR,6aR)-methyl 3-methylene-4-oxooctahydropentalene-3a-carboxylate
• Molecular Formula: C₁₁H₁₄O₃
• Molecular Weight: 194.23
• CAS Registry Number: 688799-51-1
• SMILES: COC(=O)[C@]12[C@H](CCC1=C)CCC2=O
• InChI: 1S/C11H14O3/c1-7-3-4-8-5-6-9(12)11(7,8)10(13)14-2/h8H,1,3-6H2,2H3/t8-,11+/m1/s1
• InChIKey: LZOHRSWFFQAIGD-KCJUWKMLSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 276.7±33.0°C at 760 mmHg (Cal.)
• Flash point: 118.0±25.4°C (Cal.)
• Refractive index: 1.506 (Cal.)