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CHEBI:39901 - 3,4-dimethylaniline

ChEBI IDCHEBI:39901
ChEBI Name3,4-dimethylaniline
Stars
DefinitionA primary arylamine that is aniline in which the hydrogens at the 3- and 4-positions are replaced by methyl groups. A low-melting, crystalline solid, it is used in the production of vitamin B2, dyes, pesticides and other chemicals.
Last Modified24 February 2014
DownloadsMolfile
FormulaC8H11N
Net Charge0
Average Mass121.183
Monoisotopic Mass121.08915
SMILESCc1ccc(N)cc1C
InChIInChI=1S/C8H11N/c1-6-3-4-8(9)5-7(6)2/h3-5H,9H2,1-2H3
InChIKeyDOLQYFPDPKPQSS-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
3,4-dimethylaniline (CHEBI:39901) is a dimethylaniline (CHEBI:23806)
3,4-dimethylaniline (CHEBI:39901) is a primary arylamine (CHEBI:50471)
IUPAC Name 
3,4-dimethylaniline
Synonyms  Source
3,4-DIMETHYLANILINEPDBeChem
3,4-xylidineChemIDplus
1-amino-3,4-dimethylbenzeneChemIDplus
3,4-dimethylaminobenzeneChemIDplus
3,4-dimethylbenzenamineChemIDplus
3,4-dimethylphenylamineChemIDplus
Manual XrefsDatabases
34APDBeChem
DB03018DrugBank
3,4-xylidineWikipedia
Registry NumbersSources
Reaxys:507414Reaxys
CAS:95-64-7ChemIDplus
CAS:95-64-7NIST Chemistry WebBook
Citations