2,2-bis(hydroxymethyl)propane-1,3-diol; 2-methylprop-2-enoate; prop-2-enoate

Systemtic Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; 2-methylprop-2-enoate; prop-2-enoate Openeye Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; 2-methylprop-2-enoate; prop-2-enoate CAS Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; 2-methyl-2-propenoate; 2-propenoate IUPAC Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; 2-methylprop-2-enoate; prop-2-enoate Traditional Name: acrylate; 2,2-dimethylolpropane-1,3-diol; methacrylate Formula: C31H48O20-6 MolecularWeight: 740.70082

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)[O-].CC(=C)C(=O)[O-].CC(=C)C(=O)[O-].C=CC(=O)[O-].C=CC(=O)[O-].C=CC(=O)[O-].C(C(CO)(CO)CO)O.C(C(CO)(CO)CO)O

Isomeric SMILES

CC(=C)C(=O)[O-].CC(=C)C(=O)[O-].CC(=C)C(=O)[O-].C=CC(=O)[O-].C=CC(=O)[O-].C=CC(=O)[O-].C(C(CO)(CO)CO)O.C(C(CO)(CO)CO)O

InChI

InChI=1S/2C5H12O4.3C4H6O2.3C3H4O2/c2*6-1-5(2-7,3-8)4-9;3*1-3(2)4(5)6;3*1-2-3(4)5/h2*6-9H,1-4H2;3*1H2,2H3,(H,5,6);3*2H,1H2,(H,4,5)/p-6