Cholesta-4,6-Dien-3beta-Yl Benzoate
[CAS# 25485-34-1]

Identification

• Name: Cholesta-4,6-Dien-3beta-Yl Benzoate
• Synonyms: [17-(1,5-Dimethylhexyl)-10,13-Dimethyl-2,3,8,9,11,12,14,15,16,17-Decahydro-1H-Cyclopenta[A]Phenanthren-3-Yl] Benzoate; Benzoic Acid [17-(1,5-Dimethylhexyl)-10,13-Dimethyl-2,3,8,9,11,12,14,15,16,17-Decahydro-1H-Cyclopenta[A]Phenanthren-3-Yl] Ester; Cholesta-4,6-Dien-3Beta-Yl Benzoate
• Molecular Formula: C₃₄H₄₈O₂
• Molecular Weight: 488.75
• CAS Registry Number: 25485-34-1
• EINECS: 247-021-3
• SMILES: C1=CC=CC=C1C(OC5C=C4C(C3C(C2C(C(C(CCCC(C)C)C)CC2)(C)CC3)C=C4)(CC5)C)=O
• InChI: 1S/C34H48O2/c1-23(2)10-9-11-24(3)29-16-17-30-28-15-14-26-22-27(36-32(35)25-12-7-6-8-13-25)18-20-33(26,4)31(28)19-21-34(29,30)5/h6-8,12-15,22-24,27-31H,9-11,16-21H2,1-5H3
• InChIKey: KJRLFFDMSLSIGS-UHFFFAOYSA-N

Properties

• Density: 1.051g/cm³ (Cal.)
• Boiling point: 573.603°C at 760 mmHg (Cal.)
• Flash point: 256.809°C (Cal.)