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2,2-bis(hydroxymethyl)butyl octanoate

2,2-bis(hydroxymethyl)butyl octanoate

Systemtic Name:2,2-bis(hydroxymethyl)butyl octanoate
Openeye Name:2,2-bis(hydroxymethyl)butyl octanoate
CAS Name:octanoic acid 2,2-bis(hydroxymethyl)butyl ester
IUPAC Name:2,2-bis(hydroxymethyl)butyl octanoate
Traditional Name:caprylic acid 2,2-dimethylolbutyl ester
Formula: C14H28O4
MolecularWeight: 260.36972
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OCC(CC)(CO)CO


Isomeric SMILES

CCCCCCCC(=O)OCC(CC)(CO)CO


InChI

InChI=1S/C14H28O4/c1-3-5-6-7-8-9-13(17)18-12-14(4-2,10-15)11-16/h15-16H,3-12H2,1-2H3


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