heptan-2-yl dodecanoate

Systemtic Name: heptan-2-yl dodecanoate Openeye Name: 1-methylhexyl dodecanoate CAS Name: dodecanoic acid heptan-2-yl ester IUPAC Name: heptan-2-yl dodecanoate Traditional Name: lauric acid 1-methylhexyl ester Formula: C19H38O2 MolecularWeight: 298.50382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OC(C)CCCCC

Isomeric SMILES

CCCCCCCCCCCC(=O)OC(C)CCCCC

InChI

InChI=1S/C19H38O2/c1-4-6-8-9-10-11-12-13-15-17-19(20)21-18(3)16-14-7-5-2/h18H,4-17H2,1-3H3