Stigmasterol Acetate
[CAS# 4651-48-3]

Identification

• Name: Stigmasterol Acetate
• Synonyms: [17-[(Z)-4-Ethyl-1,5-Dimethyl-Hex-2-Enyl]-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Yl] Acetate; Acetic Acid [17-[(Z)-4-Ethyl-1,5-Dimethylhex-2-Enyl]-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Yl] Ester; Acetic Acid [17-[(Z)-4-Ethyl-1,5-Dimethyl-Hex-2-Enyl]-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Yl] Ester
• Molecular Formula: C₃₁H₅₀O₂
• Molecular Weight: 454.73
• CAS Registry Number: 4651-48-3
• EINECS: 225-082-7
• SMILES: C(C(\C=C/C(C4C2(C(C1CC=C3C(C1CC2)(CCC(OC(=O)C)C3)C)CC4)C)C)C(C)C)C
• InChI: 1S/C31H50O2/c1-8-23(20(2)3)10-9-21(4)27-13-14-28-26-12-11-24-19-25(33-22(5)32)15-17-30(24,6)29(26)16-18-31(27,28)7/h9-11,20-21,23,25-29H,8,12-19H2,1-7H3/b10-9-
• InChIKey: IZEUIYYDWBKERE-KTKRTIGZSA-N

Properties

• Density: 0.999g/cm³ (Cal.)
• Boiling point: 513.561°C at 760 mmHg (Cal.)
• Flash point: 261.51°C (Cal.)