Calcium 12-(Acetoxy)Octadecanoate
[CAS# 68171-61-9]

Identification

• Name: Calcium 12-(Acetoxy)Octadecanoate
• Synonyms: Calcium 12-Acetoxyoctadecanoate; Calcium 12-Acetoxystearate; Octadecanoic Acid, 12-(Acetyloxy)-, Calcium Salt
• Molecular Formula: C₄₀H₇₄CaO₈
• Molecular Weight: 723.10
• CAS Registry Number: 68171-61-9
• EINECS: 269-033-8
• SMILES: C(C(OC(=O)C)CCCCCC)CCCCCCCCCC([O-])=O.C(C(OC(=O)C)CCCCCC)CCCCCCCCCC([O-])=O.[Ca++]
• InChI: 1S/2C20H38O4.Ca/c2*1-3-4-5-12-15-19(24-18(2)21)16-13-10-8-6-7-9-11-14-17-20(22)23;/h2*19H,3-17H2,1-2H3,(H,22,23);/q;;+2/p-2
• InChIKey: OELKSGXMBPJHFW-UHFFFAOYSA-L

Properties

• Boiling point: 448.7°C at 760 mmHg (Cal.)
• Flash point: 143.6°C (Cal.)