Calcium Octadecyl Adipate
[CAS# 94109-12-3]

Identification

• Name: Calcium Octadecyl Adipate
• Synonyms: Calcium Octadecyl Adipate; Calcium 6-Octadecoxy-6-Oxo-Hexanoate; Calcium 6-Keto-6-Stearyloxy-Hexanoate
• Molecular Formula: C₂₄H₄₅CaO₄
• Molecular Weight: 437.70
• CAS Registry Number: 94109-12-3
• EINECS: 302-450-6
• SMILES: C(C(OCCCCCCCCCCCCCCCCCC)=O)CCCC([O-])=O.[Ca++]
• InChI: 1S/C24H46O4.Ca/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-28-24(27)21-18-17-20-23(25)26;/h2-22H2,1H3,(H,25,26);/q;+2/p-1
• InChIKey: QVNRJGRAFRYGSL-UHFFFAOYSA-M

Properties

• Boiling point: 507.7°C at 760 mmHg (Cal.)
• Flash point: 157.3°C (Cal.)