(2aR,3R,4E,7bR)-4-Ethylidene-3-hydroxy-2a,3,4,6,7,7b-hexahydro-2-oxa-7a-azacyclopenta[cd]inden-1-one
[CAS# 95119-34-9]

Identification

• Name: (2aR,3R,4E,7bR)-4-Ethylidene-3-hydroxy-2a,3,4,6,7,7b-hexahydro-2-oxa-7a-azacyclopenta[cd]inden-1-one
• Synonyms: (2R,2aR,2a1R,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: 95119-34-9
• SMILES: C/C=C\1/[C@H]([C@H]2[C@H]3C1=CCCN3C(=O)O2)O
• 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-/m1/s1
• InChIKey: OJIUACOQFBQCDF-XJHNLIJHSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 490.2±45.0°C at 760 mmHg (Cal.)
• Flash point: 250.3±28.7°C (Cal.)