3,6-bis(hydroxymethyl)-2-methyl-pyran-4-one

Systemtic Name: 3,6-bis(hydroxymethyl)-2-methyl-pyran-4-one Openeye Name: 3,6-bis(hydroxymethyl)-2-methyl-pyran-4-one CAS Name: 3,6-bis(hydroxymethyl)-2-methyl-4-pyranone IUPAC Name: 3,6-bis(hydroxymethyl)-2-methylpyran-4-one Traditional Name: 2-methyl-3,6-dimethylol-pyran-4-one Formula: C8H10O4 MolecularWeight: 170.1626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C=C(O1)CO)CO

Isomeric SMILES

CC1=C(C(=O)C=C(O1)CO)CO

InChI

InChI=1S/C8H10O4/c1-5-7(4-10)8(11)2-6(3-9)12-5/h2,9-10H,3-4H2,1H3