2,2-bis(hydroxymethyl)propane-1,3-diol; 2-methylhexanoic acid

Systemtic Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; 2-methylhexanoic acid Openeye Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; 2-methylhexanoic acid CAS Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; 2-methylhexanoic acid IUPAC Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; 2-methylhexanoic acid Traditional Name: 2,2-dimethylolpropane-1,3-diol; 2-methylhexanoic acid Formula: C12H26O6 MolecularWeight: 266.33124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)C(=O)O.C(C(CO)(CO)CO)O

Isomeric SMILES

CCCCC(C)C(=O)O.C(C(CO)(CO)CO)O

InChI

InChI=1S/C7H14O2.C5H12O4/c1-3-4-5-6(2)7(8)9;6-1-5(2-7,3-8)4-9/h6H,3-5H2,1-2H3,(H,8,9);6-9H,1-4H2