EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:518305 - 2,5-dimethylaniline

Default Structure
ChEBI IDCHEBI:518305
ChEBI Name2,5-dimethylaniline
Stars
DefinitionA primary arylamine that is aniline in which the hydrogens at the 2- and 5-positions are replaced by methyl groups. It is used in the manufacture of dyes and other chemicals.
Secondary ChEBI IDCHEBI:46536
Last Modified28 July 2014
DownloadsMolfile
FormulaC8H11N
Net Charge0
Average Mass121.183
Monoisotopic Mass121.08915
SMILESCc1ccc(C)c(N)c1
InChIInChI=1S/C8H11N/c1-6-3-4-7(2)8(9)5-6/h3-5H,9H2,1-2H3
InChIKeyVOWZNBNDMFLQGM-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)
2,5-dimethylaniline (CHEBI:518305) is a dimethylaniline (CHEBI:23806)
2,5-dimethylaniline (CHEBI:518305) is a primary arylamine (CHEBI:50471)
IUPAC Name 
2,5-dimethylaniline
Synonyms  Source
1-amino-2,5-dimethylbenzeneChemIDplus
2,5-DIMETHYLANILINEPDBeChem
2,5-dimethylbenzenamineChemIDplus
2,5-Dimethyl-benzenamineKEGG COMPOUND
2,5-dimethylbenzeneamineChEBI
2,5-dimethylphenylamineChemIDplus
Manual XrefsDatabases
2,5-XylidineWikipedia
C18993KEGG COMPOUND
DB02163DrugBank
XYDPDBeChem
Registry NumbersSources
Reaxys:2205178Reaxys
CAS:95-78-3NIST Chemistry WebBook
CAS:95-78-3KEGG COMPOUND
CAS:95-78-3ChemIDplus
Citations