CHEBI:138668 - N,N-dimethyl-β-alanine

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ChEBI Name N,N-dimethyl-β-alanine ChEBI ID CHEBI:138668 ChEBI ASCII Name N,N-dimethyl-beta-alanine Definition A β-amino acid that is propionic acid in which one of the hydrogens at position 3 has been replaced by a dimethylamino group. 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 Formula C5H11NO2 Net Charge 0 Average Mass 117.147 Monoisotopic Mass 117.07898 InChI InChI=1S/C5H11NO2/c1-6(2)4-3-5(7)8/h3-4H2,1-2H3,(H,7,8) InChIKey JMOXSQYGVIXBBZ-UHFFFAOYSA-N SMILES C(CCN(C)C)(=O)O Roles Classification Chemical Role(s): Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing N,N-dimethyl-β-alanine (CHEBI:138668) has functional parent N-methyl-β-alanine (CHEBI:138669) N,N-dimethyl-β-alanine (CHEBI:138668) is a β-amino acid (CHEBI:33706) N,N-dimethyl-β-alanine (CHEBI:138668) is a tertiary amino compound (CHEBI:50996) IUPAC Name N,N-dimethyl-β-alanine Synonyms Sources 3-(dimethylamino)propanoic acid IUPAC 3-(dimethylamino)propionic acid IUPAC 3-(N,N-dimethylamino)propanoic acid ChEBI 3-(N,N-dimethylamino)propionic acid ChEBI 3-dimethylaminopropanoic acid ChEBI 3-dimethylaminopropionic acid ChEBI Manual Xref Database CPD-6142 MetaCyc View more database links Registry Numbers Types Sources 1700763 Reaxys Registry Number Reaxys 6300-04-5 CAS Registry Number PubChem Citation Type Source 16737290 PubMed citation Europe PMC Last Modified 12 October 2017