2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)propane-1,3-diol; propane-1,2,3-triol

Systemtic Name: 2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)propane-1,3-diol; propane-1,2,3-triol Openeye Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; glycerol; isobenzofuran-1,3-dione CAS Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; isobenzofuran-1,3-dione; propane-1,2,3-triol IUPAC Name: 2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)propane-1,3-diol; propane-1,2,3-triol Traditional Name: 2,2-dimethylolpropane-1,3-diol; glycerol; phthalic anhydride Formula: C16H24O10 MolecularWeight: 376.35576

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)OC2=O.C(C(CO)O)O.C(C(CO)(CO)CO)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)OC2=O.C(C(CO)O)O.C(C(CO)(CO)CO)O

InChI

InChI=1S/C8H4O3.C5H12O4.C3H8O3/c9-7-5-3-1-2-4-6(5)8(10)11-7;6-1-5(2-7,3-8)4-9;4-1-3(6)2-5/h1-4H;6-9H,1-4H2;3-6H,1-2H2