(1E,4R,7aS)-1-Ethylidene-4-methoxy-1,4,5,6,7,7a-hexahydro-2H-inden-2-one
[CAS# 628317-41-9]

Identification

• Name: (1E,4R,7aS)-1-Ethylidene-4-methoxy-1,4,5,6,7,7a-hexahydro-2H-inden-2-one
• Synonyms: (4R,7aS,E)-1-ethylidene-4-methoxy-5,6,7,7a-tetrahydro-1H-inden-2(4H)-one
• Molecular Formula: C₁₂H₁₆O₂
• Molecular Weight: 192.25
• CAS Registry Number: 628317-41-9
• SMILES: C/C=C/1\[C@H]2CCC[C@H](C2=CC1=O)OC
• InChI: 1S/C12H16O2/c1-3-8-9-5-4-6-12(14-2)10(9)7-11(8)13/h3,7,9,12H,4-6H2,1-2H3/b8-3+/t9-,12-/m1/s1
• InChIKey: IXKBCNRZABGSMO-VRHOFXPVSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 321.7±31.0°C at 760 mmHg (Cal.)
• Flash point: 144.5±18.4°C (Cal.)
• Refractive index: 1.519 (Cal.)