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CHEBI:143768 - neopentyl glycol

ChEBI IDCHEBI:143768
ChEBI Nameneopentyl glycol
Stars
DefinitionA propane-1,3-diol carrying two methyl groups at position 2.
Last Modified27 May 2019
SubmitterAdnan
DownloadsMolfile
FormulaC5H12O2
Net Charge0
Average Mass104.149
Monoisotopic Mass104.08373
SMILESCC(C)(CO)CO
InChIInChI=1S/C5H12O2/c1-5(2,3-6)4-7/h6-7H,3-4H2,1-2H3
InChIKeySLCVBVWXLSEKPL-UHFFFAOYSA-N
Wikipedia
ChEBI Ontology
Outgoing Relation(s)
neopentyl glycol (CHEBI:143768) is a propane-1,3-diols (CHEBI:26287)
IUPAC Name 
2,2-dimethylpropane-1,3-diol
Synonyms  Source
neopentylglycolChEBI
NPG glycolChEBI
2,2-dimethyl-1,3-propanediolNIST Chemistry WebBook
1,3-dihydroxy-2,2-dimethylpropaneChEBI
neopentyl glycolChemIDplus
neopentanediolChemIDplus
Manual XrefsDatabases
Neopentyl_glycolWikipedia
Registry NumbersSources
Beilstein:605291Beilstein
CAS:126-30-7ChemIDplus
CAS:126-30-7NIST Chemistry WebBook
Citations