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CHEBI:76210 - 4-{bis[4-(dimethylamino)phenyl]methyl}phenol

Default Structure
ChEBI IDCHEBI:76210
ChEBI Name4-{bis[4-(dimethylamino)phenyl]methyl}phenol
Stars
DefinitionA tertiary amino compound in which the para positions of the three phenyl rings in triphenylmethane are substituted with two dimethylamino groups and one hydroxy group.
Last Modified6 November 2013
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC23H26N2O
Net Charge0
Average Mass346.474
Monoisotopic Mass346.20451
SMILESCN(C)c1ccc(C(c2ccc(O)cc2)c2ccc(N(C)C)cc2)cc1
InChIInChI=1S/C23H26N2O/c1-24(2)20-11-5-17(6-12-20)23(19-9-15-22(26)16-10-19)18-7-13-21(14-8-18)25(3)4/h5-16,23,26H,1-4H3
InChIKeyZTXGOUSDKAXJJB-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
4-{bis[4-(dimethylamino)phenyl]methyl}phenol (CHEBI:76210) has parent hydride triphenylmethane (CHEBI:76212)
4-{bis[4-(dimethylamino)phenyl]methyl}phenol (CHEBI:76210) is a phenols (CHEBI:33853)
4-{bis[4-(dimethylamino)phenyl]methyl}phenol (CHEBI:76210) is a tertiary amino compound (CHEBI:50996)
IUPAC Name 
4-{bis[4-(dimethylamino)phenyl]methyl}phenol
Synonyms  Source
4-hydroxy-4',4''-(dimethylamino)triphenylmethaneChEBI
(4-hydroxyphenyl)bis(4-dimethylaminophenyl)methaneChEBI
Manual XrefsDatabases
1OMPDBeChem
Registry NumbersSources
Reaxys:2992513Reaxys
CAS:652-46-0Reaxys