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2-ethylhexyl docosanoate

2-ethylhexyl docosanoate

Systemtic Name:2-ethylhexyl docosanoate
Openeye Name:2-ethylhexyl docosanoate
CAS Name:docosanoic acid 2-ethylhexyl ester
IUPAC Name:2-ethylhexyl docosanoate
Traditional Name:behenic acid 2-ethylhexyl ester
Formula: C30H60O2
MolecularWeight: 452.7962
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)OCC(CC)CCCC


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)OCC(CC)CCCC


InChI

InChI=1S/C30H60O2/c1-4-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-27-30(31)32-28-29(6-3)26-8-5-2/h29H,4-28H2,1-3H3


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