(9Z)-9-Octadecenoic Acid 1,1'-[2,2-Bis(Hydroxymethyl)-1,3-Propanediyl] Ester
[CAS# 25151-96-6]

Identification

• Name: (9Z)-9-Octadecenoic Acid 1,1'-[2,2-Bis(Hydroxymethyl)-1,3-Propanediyl] Ester
• Synonyms: [2,2-Bis(Hydroxymethyl)-3-[(E)-Octadec-9-Enoyl]Oxy-Propyl] (E)-Octadec-9-Enoate; (E)-Octadec-9-Enoic Acid [2,2-Bis(Hydroxymethyl)-3-[(E)-1-Oxooctadec-9-Enoxy]Propyl] Ester; (E)-Octadec-9-Enoic Acid [2,2-Dimethylol-3-[(E)-Octadec-9-Enoyl]Oxy-Propyl] Ester
• Molecular Formula: C₄₁H₇₆O₆
• Molecular Weight: 665.05
• CAS Registry Number: 25151-96-6
• EINECS: 246-665-2
• SMILES: C(C(COC(CCCCCCC\C=C\CCCCCCCC)=O)(CO)CO)OC(CCCCCCC\C=C\CCCCCCCC)=O
• InChI: 1S/C41H76O6/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-39(44)46-37-41(35-42,36-43)38-47-40(45)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,42-43H,3-16,21-38H2,1-2H3/b19-17+,20-18+
• InChIKey: BJXXCOMGRRCAGN-XPWSMXQVSA-N

Properties

• Density: 0.957g/cm³ (Cal.)
• Boiling point: 688.227°C at 760 mmHg (Cal.)
• Flash point: 187.777°C (Cal.)