(1R,1aS,6aR)-4-Cyano-1,1A,6,6A-Tetrahydrocyclopropa[a]Indene-1-Carboxylic Acid
[CAS# 501373-10-0]

Identification

• Name: (1R,1aS,6aR)-4-Cyano-1,1A,6,6A-Tetrahydrocyclopropa[a]Indene-1-Carboxylic Acid
• Molecular Formula: C₁₂H₉NO₂
• Molecular Weight: 199.21
• CAS Registry Number: 501373-10-0
• SMILES: C1[C@@H]2[C@@H]([C@@H]2C(=O)O)C3=C1C=C(C=C3)C#N
• InChI: 1S/C12H9NO2/c13-5-6-1-2-8-7(3-6)4-9-10(8)11(9)12(14)15/h1-3,9-11H,4H2,(H,14,15)/t9-,10+,11-/m1/s1
• InChIKey: OJBRQBOJUAXVLU-OUAUKWLOSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 416.2±45.0°C at 760 mmHg (Cal.)
• Flash point: 205.5±28.7°C (Cal.)
• Refractive index: 1.661 (Cal.)