(2aS,3S,4E,7bS)-4-Ethylidene-3-Hydroxy-2A,3,4,6,7,7B-Hexahydro-2-Oxa-7A-Azacyclopenta[cd]Inden-1-One
[CAS# 109958-09-0]

Identification

• Name: (2aS,3S,4E,7bS)-4-Ethylidene-3-Hydroxy-2A,3,4,6,7,7B-Hexahydro-2-Oxa-7A-Azacyclopenta[cd]Inden-1-One
• Synonyms: (2S,2aS,2a1S,E)-1-ethylidene-2-hydroxy-2,2a,5,6-tetrahydro-1H-3-oxa-4a-azacyclopenta[cd]inden-4(2a1H)-one
• Molecular Formula: C₁₁H₁₃NO₃
• Molecular Weight: 207.23
• CAS Registry Number: 109958-09-0
• SMILES: O=C1O[C@@H]3[C@@H](O)C(/C2=C/CCN1[C@@H]23)=C/C
• InChI: 1S/C11H13NO3/c1-2-6-7-4-3-5-12-8(7)10(9(6)13)15-11(12)14/h2,4,8-10,13H,3,5H2,1H3/b6-2+/t8-,9-,10-/m0/s1
• InChIKey: OJIUACOQFBQCDF-LGTNEKLTSA-N

Properties

• Density: 1.384g/cm³ (Cal.)
• Boiling point: 490.233°C at 760 mmHg (Cal.)
• Flash point: 250.284°C (Cal.)
• Refractive index: 1.631 (Cal.)