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2,2-didodecylpentadecanethioate; 2,2-dimethylpropane

2,2-didodecylpentadecanethioate; 2,2-dimethylpropane

Systemtic Name:2,2-didodecylpentadecanethioate; 2,2-dimethylpropane
Openeye Name:2,2-didodecylpentadecanethioate; neopentane
CAS Name:2,2-didodecylpentadecanethioate; 2,2-dimethylpropane
IUPAC Name:2,2-didodecylpentadecanethioate; 2,2-dimethylpropane
Traditional Name:2,2-dilaurylpentadecanethioate; neopentane
Formula: C44H89OS-
MolecularWeight: 666.24186
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CCCCCCCCCCCC)(CCCCCCCCCCCC)C(=S)[O-].CC(C)(C)C


Isomeric SMILES

CCCCCCCCCCCCCC(CCCCCCCCCCCC)(CCCCCCCCCCCC)C(=S)[O-].CC(C)(C)C


InChI

InChI=1S/C39H78OS.C5H12/c1-4-7-10-13-16-19-22-25-28-31-34-37-39(38(40)41,35-32-29-26-23-20-17-14-11-8-5-2)36-33-30-27-24-21-18-15-12-9-6-3;1-5(2,3)4/h4-37H2,1-3H3,(H,40,41);1-4H3/p-1


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