2,6-diaminotoluene (CHEBI:76288)

ChEBI > Main

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name	2,6-diaminotoluene

ChEBI ID	CHEBI:76288

Definition	A diamine that is toluene in which both of the hydrogens ortho- to the methyl group are replaced by amino groups.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C7H10N2

Net Charge

Average Mass

122.16770

Monoisotopic Mass

122.08440

InChI

InChI=1S/C7H10N2/c1-5-6(8)3-2-4-7(5)9/h2-4H,8-9H2,1H3

InChIKey

RLYCRLGLCUXUPO-UHFFFAOYSA-N

SMILES

Cc1c(N)cccc1N

Roles Classification
Chemical Role(s):	Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound )

Biological Role(s):	mutagen An agent that increases the frequency of mutations above the normal background level, usually by interacting directly with DNA and causing it damage, including base substitution.

ChEBI Ontology
Outgoing	2,6-diaminotoluene (CHEBI:76288) has parent hydride toluene (CHEBI:17578) 2,6-diaminotoluene (CHEBI:76288) has role mutagen (CHEBI:25435) 2,6-diaminotoluene (CHEBI:76288) is a diamine (CHEBI:23666) 2,6-diaminotoluene (CHEBI:76288) is a primary amino compound (CHEBI:50994)

IUPAC Name

2-methylbenzene-1,3-diamine

Last Modified

18 November 2013