Calcium 2-[[(2-Aminoethyl)Amino]Methyl]-4-Dodecylphenolate (1:2)
[CAS# 68516-56-3]

Identification

• Name: Calcium 2-[[(2-Aminoethyl)Amino]Methyl]-4-Dodecylphenolate (1:2)
• Synonyms: Calcium 2-[(2-Aminoethylamino)Methyl]-4-Dodecyl-Phenolate; Calcium 2-[(2-Aminoethylamino)Methyl]-4-Lauryl-Phenolate
• Molecular Formula: C₄₂H₇₄CaN₄O₂
• Molecular Weight: 707.15
• CAS Registry Number: 68516-56-3
• EINECS: 271-161-4
• SMILES: C1=C(C=CC(=C1CNCCN)[O-])CCCCCCCCCCCC.C2=C(C=CC(=C2CNCCN)[O-])CCCCCCCCCCCC.[Ca++]
• InChI: 1S/2C21H38N2O.Ca/c2*1-2-3-4-5-6-7-8-9-10-11-12-19-13-14-21(24)20(17-19)18-23-16-15-22;/h2*13-14,17,23-24H,2-12,15-16,18,22H2,1H3;/q;;+2/p-2
• InChIKey: CINHZNZNSOVFID-UHFFFAOYSA-L

Properties

• Boiling point: 477.6°C at 760 mmHg (Cal.)
• Flash point: 242.6°C (Cal.)