(3aR,7aR)-3-Methylene-4-oxooctahydro-3aH-indene-3a-carbonitrile
[CAS# 634929-13-8]

Identification

• Name: (3aR,7aR)-3-Methylene-4-oxooctahydro-3aH-indene-3a-carbonitrile
• Synonyms: (3aR,7aR)-3-methylene-4-oxooctahydro-1H-indene-3a-carbonitrile
• Molecular Formula: C₁₁H₁₃NO
• Molecular Weight: 175.23
• CAS Registry Number: 634929-13-8
• SMILES: N#C[C@@]21C(=C)\CC[C@H]1CCCC2=O
• InChI: 1S/C11H13NO/c1-8-5-6-9-3-2-4-10(13)11(8,9)7-12/h9H,1-6H2/t9-,11+/m1/s1
• InChIKey: JBOOIARSWLPSDH-KOLCDFICSA-N

Properties

• Density: 1.095g/cm³ (Cal.)
• Boiling point: 323.785°C at 760 mmHg (Cal.)
• Flash point: 149.62°C (Cal.)
• Refractive index: 1.517 (Cal.)