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calcium 2-dodecyloctadecanedioate

calcium 2-dodecyloctadecanedioate

Systemtic Name:calcium 2-dodecyloctadecanedioate
Openeye Name:calcium 2-dodecyloctadecanedioate
CAS Name:calcium 2-dodecyloctadecanedioate
IUPAC Name:calcium 2-dodecyloctadecanedioate
Traditional Name:calcium 2-lauryloctadecanedioate
Formula: C30H56CaO4
MolecularWeight: 520.84124
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCCCCCCCCCCCCCCC(=O)[O-])C(=O)[O-].[Ca+2]


Isomeric SMILES

CCCCCCCCCCCCC(CCCCCCCCCCCCCCCC(=O)[O-])C(=O)[O-].[Ca+2]


InChI

InChI=1S/C30H58O4.Ca/c1-2-3-4-5-6-7-13-16-19-22-25-28(30(33)34)26-23-20-17-14-11-9-8-10-12-15-18-21-24-27-29(31)32;/h28H,2-27H2,1H3,(H,31,32)(H,33,34);/q;+2/p-2


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