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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:66892 -
o
-toluidine
Main
ChEBI Ontology
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ChEBI Name
o
-toluidine
ChEBI ID
CHEBI:66892
ChEBI ASCII Name
o-toluidine
Definition
An aminotoluene in which the amino substituent is
ortho
to the methyl group.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C7H9N
Net Charge
0
Average Mass
107.15310
Monoisotopic Mass
107.07350
InChI
InChI=1S/C7H9N/c1-6-4-2-3-5-7(6)8/h2-5H,8H2,1H3
InChIKey
RNVCVTLRINQCPJ-UHFFFAOYSA-N
SMILES
Cc1ccccc1N
Roles Classification
Chemical Role
(s):
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Br
o
nsted acid).
(via
organic amino compound
)
Biological Role
(s):
carcinogenic agent
A role played by a chemical compound which is known to induce a process of carcinogenesis by corrupting normal cellular pathways, leading to the acquistion of tumoral capabilities.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
o
-toluidine (
CHEBI:66892
)
has role
carcinogenic agent (
CHEBI:50903
)
o
-toluidine (
CHEBI:66892
)
is a
aminotoluene (
CHEBI:22531
)
Incoming
5-nitro-
o
-toluidine (
CHEBI:66891
)
has functional parent
o
-toluidine (
CHEBI:66892
)
IUPAC Name
2-methylaniline
Synonyms
Sources
1-Amino-2-methylbenzene
ChemIDplus
1-Methyl-2-aminobenzene
ChemIDplus
2-Amino-1-methylbenzene
ChemIDplus
2-Aminotoluene
ChemIDplus
2-Aminotoluene
KEGG COMPOUND
2-Methyl-1-aminobenzene
ChemIDplus
2-Methylbenzamine
ChemIDplus
2-Methylbenzenamine
ChemIDplus
2-Toluidine
ChemIDplus
o-Aminotoluene
ChemIDplus
o-Methylaniline
ChemIDplus
o-Methylbenzenamine
ChemIDplus
o-Toluidine
KEGG COMPOUND
o-Tolylamine
ChemIDplus
Manual Xrefs
Databases
C14403
KEGG COMPOUND
HMDB0041965
HMDB
View more database links
Registry Numbers
Types
Sources
741981
Reaxys Registry Number
Reaxys
95-53-4
CAS Registry Number
ChemIDplus
95-53-4
CAS Registry Number
NIST Chemistry WebBook
Citations
Types
Sources
21117897
PubMed citation
Europe PMC
21320752
PubMed citation
Europe PMC
21701861
PubMed citation
Europe PMC
22004833
PubMed citation
Europe PMC
22574454
PubMed citation
Europe PMC
22708702
PubMed citation
Europe PMC
22799188
PubMed citation
Europe PMC
Last Modified
28 July 2014