3,11-Dimethylnonacosan-2-One
[CAS# 53623-10-2]

Identification

• Name: 3,11-Dimethylnonacosan-2-One
• Synonyms: 2-Nonacosanone, 3,11-Dimethyl-; 3,11-Dimethylnonacosan-2-One; 3,11-Dimethylnonacosanone
• Molecular Formula: C₃₁H₆₂O
• Molecular Weight: 450.83
• CAS Registry Number: 53623-10-2
• SMILES: C(C(C(=O)C)C)CCCCCCC(CCCCCCCCCCCCCCCCCC)C
• InChI: 1S/C31H62O/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-23-26-29(2)27-24-21-19-22-25-28-30(3)31(4)32/h29-30H,5-28H2,1-4H3
• InChIKey: GQJLFAGGBJJGDA-UHFFFAOYSA-N

Properties

• Density: 0.838g/cm³ (Cal.)
• Boiling point: 489.23°C at 760 mmHg (Cal.)
• Flash point: 119.631°C (Cal.)