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4-chlorobenzoate

Properties

Image

Occurences in reactions

MNX_ID

MNXM1459

	#reac
in my sandbox	0
in MNXref (generic)	7
in models (compartimentalized)	0

formula

C₇H₄ClO₂

charge

-1

mass

154.99053

reference

InChIKey

XRHGYUZYPHTUJZ-UHFFFAOYSA-M

InChI

InChI=1S/C7H5ClO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10)/p-1

SMILES

O=C([O-])c1ccc(Cl)cc1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:17861 chebi:17861	4-chlorobenzoate p-chlorobenzoate pCl-benzoate anion
envipath:...ea60a6ec84df envipathM:...ea60a6ec84df	4-Chlorobenzoate
sabiork.compound:6167 sabiorkM:6167 kegg.compound:C02370 keggC:C02370	4-Chlorobenzoate 4-Chlorobenzoic acid
seed.compound:cpd01582 seedM:cpd01582	4-Chlorobenzoate 4-Chlorobenzoic acid 4-chlorobenzoate
metacyc.compound:CPD-615 metacycM:CPD-615	4-chlorobenzoate 4-Chlorobenzoic acid
CHEBI:30747 chebi:30747	4-chlorobenzoic acid 4-CHLORO-BENZOIC ACID 4-Chlorobenzoic acid p-chlorbenzoic acid p-chlorobenzoic acid
envipath:...c03dfd6dda2b envipathM:...c03dfd6dda2b	S3 (4-chlorobenzoic acid)
envipath:...185f5293072a envipathM:...185f5293072a	S3 (4-chlorobenzoic acid) 4-Chlorobenzoic acid PC-1-1
envipath:...4485d851d22c envipathM:...4485d851d22c envipath:...aff389b6dfaa envipathM:...aff389b6dfaa	Spike compound 0000626
envipath:...3ad3141f7f2d envipathM:...3ad3141f7f2d	compound 0038461
chebi:11973 chebi:1803 chebi:20333 chebi:20334 chebi:49369 keggC:M_C02370 seedM:M_cpd01582	secondary/obsolete/fantasy identifier