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1,3-dinitrobenzene

PropertiesImage
MNX_IDMNXM32289 Image of MNXM32289
referencechebi:51397
formulaC6H4N2O4
global charge0
mol weight168.108
InChIKeyWDCYWAQPCXBPJA-UHFFFAOYSA-N
InChIInChI=1S/C6H4N2O4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H
SMILESO=[N+]([O-])C1=CC=CC([N+](=O)[O-])=C1
MNX internals
InChI (mnx)InChI=1/C6H4N2O4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H Image of MNXM32289
SMILES (mnx)[CH:1]1=[CH:2][C:5]([N+:7]([O-:9])=[O:10])=[CH:4][C:6]([N+:8]([O-:11])=[O:12])=[CH:3]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:51397
chebi:51397
WDCYWAQPCXBPJA-UHFFFAOYSA-N 		1,3-dinitrobenzene
1,3-Dinitrobenzol
2,4-Dinitrobenzene
DINITROPHENYLENE
m-DNB
m-Dinitrobenzene
meta-Dinitrobenzene
hmdb:HMDB0244170
WDCYWAQPCXBPJA-UHFFFAOYSA-N 		1,3-Dinitrobenzene
1,3-Dinitrobenzol
1,3-dinitrobenzene
2,4-Dinitrobenzene
2,4-dinitrobenzene
3-Dinitrobenzene
DINITROPHENYLENE
Meta-dinitrobenzene
m-DNB
m-Dinitrobenzene

metacyc.compound:13-DINITROBENZENE
metacycM:13-DINITROBENZENE
seed.compound:cpd21806
seedM:cpd21806
WDCYWAQPCXBPJA-UHFFFAOYSA-N 		1,3-dinitrobenzene

chebi:44536
seedM:M_cpd21806 		secondary/obsolete/fantasy identifier