[1R-(1alpha,3alpha,4aalpha)]-2,3,4,4a,5,6-Hexahydro-2,2-Dimethyl-1,3-Methanonaphthalen-7(1H)-One
[CAS# 68433-81-8]

Identification

• Name: [1R-(1alpha,3alpha,4aalpha)]-2,3,4,4a,5,6-Hexahydro-2,2-Dimethyl-1,3-Methanonaphthalen-7(1H)-One
• Synonyms: 1,3-Methanonaphthalen-7(1H)-One, 2,3,4,4A,5,6-Hexahydro-2,2-Dimethyl-, (1R,3S,4Ar)-; Cis-Tricyclo(7.1.1.02,7)Undec-2-En-One, 10,10-Dimethyl-
• Molecular Formula: C₁₃H₁₈O
• Molecular Weight: 190.28
• CAS Registry Number: 68433-81-8
• EINECS: 270-397-5
• SMILES: [C@H]12C(C(C1)CC3C2=CC(=O)CC3)(C)C
• InChI: 1S/C13H18O/c1-13(2)9-5-8-3-4-10(14)7-11(8)12(13)6-9/h7-9,12H,3-6H2,1-2H3/t8?,9?,12-/m0/s1
• InChIKey: OEFUEUWVTAXZDS-KWPJZBAWSA-N

Properties

• Density: 1.06g/cm³ (Cal.)
• Boiling point: 298.318°C at 760 mmHg (Cal.)
• Flash point: 124.513°C (Cal.)