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CHEBI:233687 - neopentyl glycol adipate

ChEBI IDCHEBI:233687
ChEBI Nameneopentyl glycol adipate
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FormulaC11H20O5
Net Charge0
Average Mass232.276
Monoisotopic Mass232.13107
SMILESCC(C)(CO)COC(=O)CCCCC(=O)O
InChIInChI=1S/C11H20O5/c1-11(2,7-12)8-16-10(15)6-4-3-5-9(13)14/h12H,3-8H2,1-2H3,(H,13,14)
InChIKeyUEGQJTSGVSBXCN-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)
neopentyl glycol adipate (CHEBI:233687) is a medium-chain fatty acid (CHEBI:59554)