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CHEBI:86537 - 2,2-dimethylsuccinic acid

ChEBI IDCHEBI:86537
ChEBI Name2,2-dimethylsuccinic acid
Stars
DefinitionAn α,ω-dicarboxylic acid that is succinic acid substituted by two methyl groups at positions 2 and 2 respectively.
Last Modified9 May 2022
DownloadsMolfile
FormulaC6H10O4
Net Charge0
Average Mass146.142
Monoisotopic Mass146.05791
SMILESCC(C)(CC(=O)O)C(=O)O
InChIInChI=1S/C6H10O4/c1-6(2,5(9)10)3-4(7)8/h3H2,1-2H3,(H,7,8)(H,9,10)
InChIKeyGOHPTLYPQCTZSE-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
2,2-dimethylsuccinic acid (CHEBI:86537) has functional parent succinic acid (CHEBI:15741)
2,2-dimethylsuccinic acid (CHEBI:86537) is a α,ω-dicarboxylic acid (CHEBI:28383)
2,2-dimethylsuccinic acid (CHEBI:86537) is conjugate acid of 2,2-dimethylsuccinate(2−) (CHEBI:191383)
Incoming Relation(s)
2,2-dimethylsuccinate(2−) (CHEBI:191383) is conjugate base of 2,2-dimethylsuccinic acid (CHEBI:86537)
IUPAC Name 
2,2-dimethylbutanedioic acid
Synonyms  Source
α,α-dimethylsuccinic acidChEBI
α,α-dimethyl-succinic acidHMDB
Manual XrefsDatabases
FDB022833FooDB
LMFA01170080LIPID MAPS
HMDB0002074HMDB
WOCPDBeChem
Registry NumbersSources
Reaxys:1764476Reaxys
CAS:597-43-3ChemIDplus
CAS:597-43-3NIST Chemistry WebBook
Citations