Barium Thiobis[Dodecylphenolate]
[CAS# 68832-80-4]

Identification

• Name: Barium Thiobis[Dodecylphenolate]
• Synonyms: Barium(+2) Cation; 2-Dodecyl-6-(3-Dodecyl-2-Oxido-Phenyl)Sulfanyl-Phenolate; Barium(+2) Cation; 2-Dodecyl-6-[(3-Dodecyl-2-Oxidophenyl)Thio]Phenolate; Barium(+2) Cation; 2-Lauryl-6-[(3-Lauryl-2-Oxido-Phenyl)Thio]Phenolate
• Molecular Formula: C₃₆H₅₆BaO₂S
• Molecular Weight: 690.24
• CAS Registry Number: 68832-80-4
• EINECS: 272-402-6
• SMILES: C1=CC=C(C(=C1SC2=C([O-])C(=CC=C2)CCCCCCCCCCCC)[O-])CCCCCCCCCCCC.[Ba++]
• InChI: 1S/C36H58O2S.Ba/c1-3-5-7-9-11-13-15-17-19-21-25-31-27-23-29-33(35(31)37)39-34-30-24-28-32(36(34)38)26-22-20-18-16-14-12-10-8-6-4-2;/h23-24,27-30,37-38H,3-22,25-26H2,1-2H3;/q;+2/p-2
• InChIKey: KDLZNYMSEVMRTQ-UHFFFAOYSA-L

Properties

• Boiling point: 632.8°C at 760 mmHg (Cal.)
• Flash point: 306.3°C (Cal.)