Calcium 9,12-Diiodooctadecanoate
[CAS# 74988-01-5]

Identification

• Name: Calcium 9,12-Diiodooctadecanoate
• Synonyms: Calcium 9,12-Diiodostearate; Calcium Diiodostearate; Calcium Diiodostearate (Jan)
• Molecular Formula: C₃₆H₆₆CaI₄O₄
• Molecular Weight: 1110.61
• CAS Registry Number: 74988-01-5
• SMILES: IC(CCCCCCCC([O-])=O)CCC(CCCCCC)I.C(C([O-])=O)CCCCCCC(CCC(CCCCCC)I)I.[Ca++]
• InChI: 1S/2C18H34I2O2.Ca/c2*1-2-3-4-8-11-16(19)14-15-17(20)12-9-6-5-7-10-13-18(21)22;/h2*16-17H,2-15H2,1H3,(H,21,22);/q;;+2/p-2
• InChIKey: KMDFGURWVNEJQG-UHFFFAOYSA-L

Properties

• Boiling point: 517.5°C at 760 mmHg (Cal.)
• Flash point: 266.8°C (Cal.)