[3,5-bis(2-methylpentan-2-yl)-4-oxidanyl-phenyl]methyl-octadecoxy-phosphinate; cobalt(2+)

Systemtic Name: [3,5-bis(2-methylpentan-2-yl)-4-oxidanyl-phenyl]methyl-octadecoxy-phosphinate; cobalt(2+) Openeye Name: cobaltous [3,5-bis(1,1-dimethylbutyl)-4-hydroxy-phenyl]methyl-octadecoxy-phosphinate CAS Name: cobalt(2+); [4-hydroxy-3,5-bis(2-methylpentan-2-yl)phenyl]methyl-octadecoxyphosphinate IUPAC Name: cobalt(2+); [4-hydroxy-3,5-bis(2-methylpentan-2-yl)phenyl]methyl-octadecoxyphosphinate Traditional Name: cobaltous [3,5-bis(1,1-dimethylbutyl)-4-hydroxy-benzyl]-stearyloxy-phosphinate Formula: C74H136CoO8P2 MolecularWeight: 1274.747562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOP(=O)(CC1=CC(=C(C(=C1)C(C)(C)CCC)O)C(C)(C)CCC)[O-].CCCCCCCCCCCCCCCCCCOP(=O)(CC1=CC(=C(C(=C1)C(C)(C)CCC)O)C(C)(C)CCC)[O-].[Co+2]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOP(=O)(CC1=CC(=C(C(=C1)C(C)(C)CCC)O)C(C)(C)CCC)[O-].CCCCCCCCCCCCCCCCCCOP(=O)(CC1=CC(=C(C(=C1)C(C)(C)CCC)O)C(C)(C)CCC)[O-].[Co+2]

InChI

InChI=1S/2C37H69O4P.Co/c2*1-8-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-28-41-42(39,40)31-32-29-33(36(4,5)26-9-2)35(38)34(30-32)37(6,7)27-10-3;/h2*29-30,38H,8-28,31H2,1-7H3,(H,39,40);/q;;+2/p-2