methyl 2-methylprop-2-enoate; trioctylphosphanium; bromide

Systemtic Name: methyl 2-methylprop-2-enoate; trioctylphosphanium; bromide Openeye Name: methyl 2-methylprop-2-enoate; trioctylphosphonium; bromide CAS Name: 2-methyl-2-propenoic acid methyl ester; trioctylphosphonium; bromide IUPAC Name: methyl 2-methylprop-2-enoate; trioctylphosphanium; bromide Traditional Name: 2-methylacrylic acid methyl ester; trioctylphosphonium; bromide Formula: C29H60BrO2P MolecularWeight: 551.663261

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[PH+](CCCCCCCC)CCCCCCCC.CC(=C)C(=O)OC.[Br-]

Isomeric SMILES

CCCCCCCC[PH+](CCCCCCCC)CCCCCCCC.CC(=C)C(=O)OC.[Br-]

InChI

InChI=1S/C24H51P.C5H8O2.BrH/c1-4-7-10-13-16-19-22-25(23-20-17-14-11-8-5-2)24-21-18-15-12-9-6-3;1-4(2)5(6)7-3;/h4-24H2,1-3H3;1H2,2-3H3;1H