2,2-bis(hydroxymethyl)butyl heptanoate

Systemtic Name: 2,2-bis(hydroxymethyl)butyl heptanoate Openeye Name: 2,2-bis(hydroxymethyl)butyl heptanoate CAS Name: heptanoic acid 2,2-bis(hydroxymethyl)butyl ester IUPAC Name: 2,2-bis(hydroxymethyl)butyl heptanoate Traditional Name: enanthic acid 2,2-dimethylolbutyl ester Formula: C13H26O4 MolecularWeight: 246.34314

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OCC(CC)(CO)CO

Isomeric SMILES

CCCCCCC(=O)OCC(CC)(CO)CO

InChI

InChI=1S/C13H26O4/c1-3-5-6-7-8-12(16)17-11-13(4-2,9-14)10-15/h14-15H,3-11H2,1-2H3