CHEBI:143768 - neopentyl glycol

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ChEBI Name neopentyl glycol ChEBI ID CHEBI:143768 Definition A propane-1,3-diol carrying two methyl groups at position 2. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Wikipedia License Read full article at Wikipedia Formula C5H12O2 Net Charge 0 Average Mass 104.149 Monoisotopic Mass 104.08373 InChI InChI=1S/C5H12O2/c1-5(2,3-6)4-7/h6-7H,3-4H2,1-2H3 InChIKey SLCVBVWXLSEKPL-UHFFFAOYSA-N SMILES OCC(CO)(C)C ChEBI Ontology Outgoing neopentyl glycol (CHEBI:143768) is a propane-1,3-diols (CHEBI:26287) IUPAC Name 2,2-dimethylpropane-1,3-diol Synonyms Sources 1,3-dihydroxy-2,2-dimethylpropane ChEBI 2,2-dimethyl-1,3-propanediol NIST Chemistry WebBook neopentanediol ChemIDplus neopentyl glycol ChemIDplus neopentylglycol ChEBI NPG ChEBI NPG glycol ChEBI Manual Xref Database Neopentyl_glycol Wikipedia View more database links Registry Numbers Types Sources 126-30-7 CAS Registry Number ChemIDplus 126-30-7 CAS Registry Number NIST Chemistry WebBook 605291 Beilstein Registry Number Beilstein Citations Types Sources 30918372 PubMed citation Europe PMC 31000715 PubMed citation Europe PMC Last Modified 27 May 2019