2,2-bis(hydroxymethyl)propane-1,3-diol; propan-2-one

Systemtic Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; propan-2-one Openeye Name: acetone; 2,2-bis(hydroxymethyl)propane-1,3-diol CAS Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; 2-propanone IUPAC Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; propan-2-one Traditional Name: acetone; 2,2-dimethylolpropane-1,3-diol Formula: C11H24O6 MolecularWeight: 252.30466

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C.CC(=O)C.C(C(CO)(CO)CO)O

Isomeric SMILES

CC(=O)C.CC(=O)C.C(C(CO)(CO)CO)O

InChI

InChI=1S/C5H12O4.2C3H6O/c6-1-5(2-7,3-8)4-9;2*1-3(2)4/h6-9H,1-4H2;2*1-2H3