[10,13-Dimethyl-17-(6-Methylheptan-2-Yl)-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[a]Phenanthren-3-Yl] 4-Methylbenzenesulfonate
[CAS# 1182-65-6]

Identification

• Name: [10,13-Dimethyl-17-(6-Methylheptan-2-Yl)-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[a]Phenanthren-3-Yl] 4-Methylbenzenesulfonate
• Synonyms: [17-(1,5-Dimethylhexyl)-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Yl] 4-Methylbenzenesulfonate; 4-Methylbenzenesulfonic Acid [17-(1,5-Dimethylhexyl)-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Yl] Ester; Nsc132807
• Molecular Formula: C₃₄H₅₂O₃S
• Molecular Weight: 540.84
• CAS Registry Number: 1182-65-6
• EINECS: 214-657-8
• SMILES: C5=C([S](OC2CC1=CCC3C(C1(CC2)C)CCC4(C3CCC4C(CCCC(C)C)C)C)(=O)=O)C=CC(=C5)C
• InChI: 1S/C34H52O3S/c1-23(2)8-7-9-25(4)30-16-17-31-29-15-12-26-22-27(37-38(35,36)28-13-10-24(3)11-14-28)18-20-33(26,5)32(29)19-21-34(30,31)6/h10-14,23,25,27,29-32H,7-9,15-22H2,1-6H3
• InChIKey: RNZDACWUXZHQMI-UHFFFAOYSA-N

Properties

• Density: 1.097g/cm³ (Cal.)
• Boiling point: 617.487°C at 760 mmHg (Cal.)
• Flash point: 327.245°C (Cal.)