Barium 3-Octadecylsulfanylpropanoate
[CAS# 38952-51-1]

Identification

• Name: Barium 3-Octadecylsulfanylpropanoate
• Synonyms: Barium(+2) Cation; 3-(Octadecylthio)Propanoate; Barium(+2) Cation; 3-(Stearylthio)Propionate; Barium 3-Octadecylthiopropionate
• Molecular Formula: C₄₂H₈₂BaO₄S₂
• Molecular Weight: 852.57
• CAS Registry Number: 38952-51-1
• EINECS: 254-215-1
• SMILES: C(C([O-])=O)CSCCCCCCCCCCCCCCCCCC.C(C([O-])=O)CSCCCCCCCCCCCCCCCCCC.[Ba++]
• InChI: 1S/2C21H42O2S.Ba/c2*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-24-20-18-21(22)23;/h2*2-20H2,1H3,(H,22,23);/q;;+2/p-2
• InChIKey: IBXOVGVKIOWOEQ-UHFFFAOYSA-L

Properties

• Boiling point: 477.4°C at 760 mmHg (Cal.)
• Flash point: 242.5°C (Cal.)