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2,2-bis(3,5-dimethylhexyl)pentanedioic acid

2,2-bis(3,5-dimethylhexyl)pentanedioic acid

Systemtic Name:2,2-bis(3,5-dimethylhexyl)pentanedioic acid
Openeye Name:2,2-bis(3,5-dimethylhexyl)pentanedioic acid
CAS Name:2,2-bis(3,5-dimethylhexyl)pentanedioic acid
IUPAC Name:2,2-bis(3,5-dimethylhexyl)pentanedioic acid
Traditional Name:2,2-bis(3,5-dimethylhexyl)glutaric acid
Formula: C21H40O4
MolecularWeight: 356.5399
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C)CCC(CCC(C)CC(C)C)(CCC(=O)O)C(=O)O


Isomeric SMILES

CC(C)CC(C)CCC(CCC(C)CC(C)C)(CCC(=O)O)C(=O)O


InChI

InChI=1S/C21H40O4/c1-15(2)13-17(5)7-10-21(20(24)25,12-9-19(22)23)11-8-18(6)14-16(3)4/h15-18H,7-14H2,1-6H3,(H,22,23)(H,24,25)


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