MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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1,4-dichlorobenzene

	Properties	Image
MNX_ID	MNXM4219
reference	chebi:28618
formula	C₆H₄Cl₂
global charge	0
mol weight	147.004
InChIKey	OCJBOOLMMGQPQU-UHFFFAOYSA-N
InChI	InChI=1S/C6H4Cl2/c7-5-1-2-6(8)4-3-5/h1-4H
SMILES	ClC1=CC=C(Cl)C=C1

MNX internals

InChI (mnx)	InChI=1/C6H4Cl2/c7-5-1-2-6(8)4-3-5/h1-4H
SMILES (mnx)	[CH:1]1=[CH:2][C:6]([Cl:8])=[CH:4][CH:3]=[C:5]1[Cl:7]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:28618 chebi:28618 OCJBOOLMMGQPQU-UHFFFAOYSA-N	1,4-dichlorobenzene 1,4-Dichlorobenzene PARA PDCB Paradichlorbenzol p-Dichlorbenzol p-Dichlorobenzene p-chlorophenyl chloride paradichlorobenzene
envipath:...332305415d2f envipathM:...332305415d2f OCJBOOLMMGQPQU-UHFFFAOYSA-N	1,4-Dichlorobenzene
vmhM:dclbnzn vmhmetabolite:dclbnzn OCJBOOLMMGQPQU-UHFFFAOYSA-N	1,4-Dichlorobenzene 1,4-dichlorobenzene
kegg.compound:C07092 keggC:C07092 OCJBOOLMMGQPQU-UHFFFAOYSA-N	1,4-Dichlorobenzene p-Dichlorobenzene
metacyc.compound:14-DICHLOROBENZENE metacycM:14-DICHLOROBENZENE OCJBOOLMMGQPQU-UHFFFAOYSA-N	1,4-dichlorobenzene DCB Dichloricide Evola PARA PDB PDCB Para-zene Paracide Paradow Paramoth globol p-chlorophenyl chloride p-dichlorobenzol para-Dichlorobenzene paranuggets persia-perazol santochlor
hmdb:HMDB0041971 OCJBOOLMMGQPQU-UHFFFAOYSA-N	P-Dichlorobenzene 1, 4-Dichlorobenzene 1,4-Chlorobenzene 1,4-Dichloorbenzeen 1,4-Dichlor-benzol 1,4-Dichloro-benzene 1,4-Dichlorobenzene (acd/name 4.0) 1,4-Diclorobenzene 1,4-dichlorobenzene 4-Dichlorobenzene Di-chloricide Dichlorobenzene Dichlorobenzene, p-, solid Dichlorobenzene, para Dichlorocide Evola Globol Kaydox PARA PDB PDCB Para crystals Para-dichlorobenzene Paracide Paradi Paradichlorbenzol Paradichlorobenzene Paradichlorobenzol Paradow Paramoth Paranuggets Parazene Persia-perazol Rcra waste number u070 Rcra waste number u071 Rcra waste number u072 Santochlor p-Chlorophenyl chloride p-Dichloorbenzeen p-Dichlorbenzene p-Dichlorbenzol p-Dichloro-benzene p-Dichlorobenzol p-Diclorobenzene paradi
envipath:...b18ede4082e3 envipathM:...b18ede4082e3 OCJBOOLMMGQPQU-UHFFFAOYSA-N	compound 0053469
seed.compound:cpd04367 seedM:cpd04367 OCJBOOLMMGQPQU-UHFFFAOYSA-N	p-Dichlorobenzene 1,4-Dichlorobenzene 1,4-dichlorobenzene DCB Dichloricide Evola PARA PDB PDCB Para-zene Paracide Paradow Paramoth globol p-chlorophenyl chloride p-dichlorobenzol para-Dichlorobenzene paranuggets persia-perazol santochlor
hmdb:HMDB41971 chebi:18930 chebi:536 keggC:M_C07092 seedM:M_cpd04367 vmhM:M_dclbnzn	secondary/obsolete/fantasy identifier