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3,4-dichlorobenzoic acid

PropertiesImage
MNX_IDMNXM14472 Image of MNXM14472
referencechebi:49401
formulaC7H4Cl2O2
global charge0
mol weight191.013
InChIKeyVPHHJAOJUJHJKD-UHFFFAOYSA-N
InChIInChI=1S/C7H4Cl2O2/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3H,(H,10,11)
SMILESO=C(O)C1=CC=C(Cl)C(Cl)=C1
MNX internals
InChI (mnx)InChI=1/C7H4Cl2O2/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3H,(H,10,11) Image of MNXM14472
SMILES (mnx)[CH:1]1=[CH:2][C:5]([Cl:8])=[C:6]([Cl:9])[CH:3]=[C:4]1[C:7](=[O:10])[OH:11]
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:49401
chebi:49401
VPHHJAOJUJHJKD-UHFFFAOYSA-N
3,4-dichlorobenzoic acid

metacyc.compound:CPD-11224
metacycM:CPD-11224
seed.compound:cpd22897
seedM:cpd22897
CHEBI:83287
chebi:83287
VPHHJAOJUJHJKD-UHFFFAOYSA-M
3,4-dichlorobenzoate

seedM:M_cpd22897
secondary/obsolete/fantasy identifier