CHEBI:27864 - 2,6-dichloro-4-nitroaniline

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2,6-dichloro-4-nitroaniline
ChEBI ID CHEBI:27864
Definition A nitroaniline that is 4-nitroaniline in which the hydrogens at positions 2 and 6 are replaced by chlorines. An agricultural fungicide, it is not approved for use in the European Union.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:19392, CHEBI:941
Supplier Information
Download Molfile XML SDF
more structures >>
Formula C6H4Cl2N2O2
Net Charge 0
Average Mass 207.01400
Monoisotopic Mass 205.965
InChI InChI=1S/C6H4Cl2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2
InChIKey BIXZHMJUSMUDOQ-UHFFFAOYSA-N
SMILES Nc1c(Cl)cc(cc1Cl)[N+]([O-])=O
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): antifungal agrochemical
Any substance used in acriculture, horticulture, forestry, etc. for its fungicidal properties.
fungicide
A substance used to destroy fungal pests.
(via aromatic fungicide )
Application(s): antifungal agrochemical
Any substance used in acriculture, horticulture, forestry, etc. for its fungicidal properties.
fungicide
A substance used to destroy fungal pests.
(via aromatic fungicide )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2,6-dichloro-4-nitroaniline (CHEBI:27864) has role antifungal agrochemical (CHEBI:86328)
2,6-dichloro-4-nitroaniline (CHEBI:27864) is a aromatic fungicide (CHEBI:87034)
2,6-dichloro-4-nitroaniline (CHEBI:27864) is a dichlorobenzene (CHEBI:23697)
2,6-dichloro-4-nitroaniline (CHEBI:27864) is a nitroaniline (CHEBI:25550)
IUPAC Name
2,6-dichloro-4-nitroaniline
Synonyms Sources
1-amino-2,6-dichloro-4-nitrobenzene NIST Chemistry WebBook
2,6-dichloro-4-nitrobenzenamine ChemIDplus
4-nitro-2,6-dichloroaniline ChemIDplus
CNA NIST Chemistry WebBook
DCNA KEGG COMPOUND
Dichloran KEGG COMPOUND
dicloran
Note: (2014-10-21) Note that 'Dicloran' is also used as a trade name for the anti-inflammatory drug diclofenac sodium.
ChemIDplus
Brand Names Sources
Allisan ChemIDplus
Batran ChemIDplus
Bortran ChemIDplus
Botran ChemIDplus
Ditranil ChemIDplus
Resisan NIST Chemistry WebBook
Manual Xrefs Databases
222 PPDB
C11000 KEGG COMPOUND
dicloran Alan Wood's Pesticides
View more database links
Registry Numbers Types Sources
1459581 Reaxys Registry Number Reaxys
99-30-9 CAS Registry Number KEGG COMPOUND
99-30-9 CAS Registry Number NIST Chemistry WebBook
99-30-9 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
1692105 PubMed citation Europe PMC
2625222 PubMed citation Europe PMC
8720094 PubMed citation Europe PMC
IND44384091 Agricola citation Europe PMC
Last Modified
21 July 2015