2,2-dimethylsuccinic Acid

2_2_dimethylsuccinic_acid synonyms

2,2-Dimethylbutanedioic acid; 2,2-Dimethylsuccinic acid; 2,2-dimethylbutanedioic acid


Graphical representations:


View large 3D structure

Molecular Formula: C6H10O4

Natural Isotopic Abundance Mass: 146.1412

Mono-Isotopic Molecular Masses:

  • C12N14: 146.0579088094
  • C13N14: 152.0780378362
  • C12N15: 146.0579088094
  • C13N15: 152.0780378362

InChI string: InChI=1S/C6H10O4/c1-6(2,5(9)10)3-4(7)8/h3H2,1-2H3,(H,7,8)(H,9,10)

CAS Registry number: 597-43-3
CAS Registry number: 597-43-3
EPA DSSTox: 21581
KEGG Compound ID: D186007_ALDRICH
LipidMAPS: LMFA01170080
MMCD: cq_17628
NIST Chemistry WebBook: 3976863353
PubChem Compound (CID): 11701
Sigma-Aldrich: D186007_ALDRICH

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.

InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73, https://www.nature.com/articles/sdata201773)