Tricyclo[8.2.1.0^3,8]Trideca-3,5,7-Trien-13-One
[CAS# 54962-18-4]

Identification

• Name: Tricyclo[8.2.1.0^3,8]Trideca-3,5,7-Trien-13-One
• Synonyms: 11-Oxo-5,6,7,8,9,10-hexahydro-6,9-methanobenzocyclooctene; tricyclo[8.2.1.0<3,8>]trideca-3(8),4,6-trien-13-one; Tricyclo[8.2.1.03,8]trideca-3(8),4,6-trien-13-one
• Molecular Formula: C₁₃H₁₄O
• Molecular Weight: 186.25
• CAS Registry Number: 54962-18-4
• SMILES: O=C2C3Cc1c(cccc1)CC2CC3
• InChI: 1S/C13H14O/c14-13-11-5-6-12(13)8-10-4-2-1-3-9(10)7-11/h1-4,11-12H,5-8H2
• InChIKey: CMCAOQYLMULHEZ-UHFFFAOYSA-N

Properties

• Density: 1.115g/cm³ (Cal.)
• Boiling point: 325.176°C at 760 mmHg (Cal.)
• Flash point: 140.543°C (Cal.)