3-[3,4a,6-Trimethyl-2-[(2E,4E)-4-Methylhexa-2,4-Dien-2-Yl]2,5,6,7,8,8a-Hexahydro-1H-Naphthalene-1-Carbonyl]-5-Hydroxy-5-(Phenylmethyl)-1H-Pyrrol-2-One
[CAS# 170591-45-4]

Identification

• Name: 3-[3,4a,6-Trimethyl-2-[(2E,4E)-4-Methylhexa-2,4-Dien-2-Yl]2,5,6,7,8,8a-Hexahydro-1H-Naphthalene-1-Carbonyl]-5-Hydroxy-5-(Phenylmethyl)-1H-Pyrrol-2-One
• Synonyms: 3-[2-[(1E,3E)-1,3-Dimethylpenta-1,3-Dienyl]-3,4A,6-Trimethyl-2,5,6,7,8,8A-Hexahydro-1H-Naphthalene-1-Carbonyl]-5-Hydroxy-5-(Phenylmethyl)-1H-Pyrrol-2-One; 3-[[2-[(1E,3E)-1,3-Dimethylpenta-1,3-Dienyl]-3,4A,6-Trimethyl-2,5,6,7,8,8A-Hexahydro-1H-Naphthalen-1-Yl]-Oxomethyl]-5-Hydroxy-5-(Phenylmethyl)-1H-Pyrrol-2-One; 5-(Benzyl)-3-[2-[(1E,3E)-1,3-Dimethylpenta-1,3-Dienyl]-3,4A,6-Trimethyl-2,5,6,7,8,8A-Hexahydro-1H-Naphthalene-1-Carbonyl]-5-Hydroxy-3-Pyrrolin-2-One
• Molecular Formula: C₃₂H₄₁NO₃
• Molecular Weight: 487.68
• CAS Registry Number: 170591-45-4
• SMILES: C4=C(CC1(O)NC(=O)C(=C1)C(=O)C2C3C(C=C(C2C(=C/C(=C/C)C)/C)C)(CC(CC3)C)C)C=CC=C4
• InChI: 1S/C32H41NO3/c1-7-20(2)15-22(4)27-23(5)17-31(6)16-21(3)13-14-26(31)28(27)29(34)25-19-32(36,33-30(25)35)18-24-11-9-8-10-12-24/h7-12,15,17,19,21,26-28,36H,13-14,16,18H2,1-6H3,(H,33,35)/b20-7+,22-15+
• InChIKey: LERBUEGMFSDFOI-HNRJQCQOSA-N

Properties

• Density: 1.105g/cm³ (Cal.)
• Boiling point: 674.861°C at 760 mmHg (Cal.)
• Flash point: 361.943°C (Cal.)