2-Methyl-3-[(2E,7R,11R)-3,7,11,15-Tetramethyl-2-Hexadecenyl]-1,4-Naphthalenediol Diacetate
[CAS# 604-87-5]

Identification

• Name: 2-Methyl-3-[(2E,7R,11R)-3,7,11,15-Tetramethyl-2-Hexadecenyl]-1,4-Naphthalenediol Diacetate
• Synonyms: [4-Acetoxy-2-Methyl-3-[(E,7R,11R)-3,7,11,15-Tetramethylhexadec-2-Enyl]-1-Naphthyl] Acetate; Acetic Acid [4-Acetoxy-2-Methyl-3-[(E,7R,11R)-3,7,11,15-Tetramethylhexadec-2-Enyl]-1-Naphthyl] Ester; [4-Acetyloxy-2-Methyl-3-[(E,7R,11R)-3,7,11,15-Tetramethylhexadec-2-Enyl]Naphthalen-1-Yl] Ethanoate
• Molecular Formula: C₃₅H₅₂O₄
• Molecular Weight: 536.79
• CAS Registry Number: 604-87-5
• SMILES: [C@H](CCC/C(=C/CC1=C(C(=C2C(=C1OC(=O)C)C=CC=C2)OC(=O)C)C)C)(CCC[C@@H](CCCC(C)C)C)C
• InChI: 1S/C35H52O4/c1-24(2)14-11-15-25(3)16-12-17-26(4)18-13-19-27(5)22-23-31-28(6)34(38-29(7)36)32-20-9-10-21-33(32)35(31)39-30(8)37/h9-10,20-22,24-26H,11-19,23H2,1-8H3/b27-22+/t25-,26-/m1/s1
• InChIKey: OMMWEESMXJLLLQ-LGWQWDGZSA-N

Properties

• Density: 0.995g/cm³ (Cal.)
• Boiling point: 603.917°C at 760 mmHg (Cal.)
• Flash point: 289.884°C (Cal.)