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2,2-dibutyldodecanoate; octadecanoic acid

2,2-dibutyldodecanoate; octadecanoic acid

Systemtic Name:2,2-dibutyldodecanoate; octadecanoic acid
Openeye Name:2,2-dibutyldodecanoate; stearic acid
CAS Name:2,2-dibutyldodecanoate; octadecanoic acid
IUPAC Name:2,2-dibutyldodecanoate; octadecanoic acid
Traditional Name:2,2-dibutyllaurate; stearic acid
Formula: C38H75O4-
MolecularWeight: 595.9997
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCCCCCC(CCCC)(CCCC)C(=O)[O-]


Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCCCCCC(CCCC)(CCCC)C(=O)[O-]


InChI

InChI=1S/C20H40O2.C18H36O2/c1-4-7-10-11-12-13-14-15-18-20(19(21)22,16-8-5-2)17-9-6-3;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h4-18H2,1-3H3,(H,21,22);2-17H2,1H3,(H,19,20)/p-1


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