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Chemical structure of 3,3-Dimethylglutaric acid

GC60491

3,3-Dimethylglutaric acid

Also known as 3,3-dimethylpentanedioic acid

3,3-Dimethylglutaric acid, a member of methyl-branched fatty acids, is a endogenous metabolite occasionally found in human urine

ChemicalCAS4839-46-7MW160.17FormulaC7H12O4
CAS number
4839-46-7
Molecular weight
160.17
Formula
C7H12O4
InChIKey
DUHQIGLHYXLKAE-UHFFFAOYSA-N
Catalogue number
GC60491
Brand
GLPBIO
Computed properties PubChem CID 20984 · XLogP 0.4 · TPSA 74.6 Ų · H-bond donors 2
XLogP
0.4
TPSA
74.6 Ų
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
11

SMILES CC(C)(CC(=O)O)CC(=O)O

Computed descriptors from PubChem (CID 20984), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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