CHEBI:83287 - 3,4-dichlorobenzoate

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ChEBI Name 3,4-dichlorobenzoate ChEBI ID CHEBI:83287 Definition A chlorobenzoate obtained by deprotonation of the carboxy group of 3,4-dichlorobenzoic acid. The major species at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C7H3Cl2O2 Net Charge -1 Average Mass 190.00400 Monoisotopic Mass 188.95156 InChI InChI=1S/C7H4Cl2O2/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3H,(H,10,11)/p-1 InChIKey VPHHJAOJUJHJKD-UHFFFAOYSA-M SMILES [O-]C(=O)c1ccc(Cl)c(Cl)c1 ChEBI Ontology Outgoing 3,4-dichlorobenzoate (CHEBI:83287) is a chlorobenzoate (CHEBI:23133) 3,4-dichlorobenzoate (CHEBI:83287) is conjugate base of 3,4-dichlorobenzoic acid (CHEBI:49401) Incoming 3,4-dichlorobenzoic acid (CHEBI:49401) is conjugate acid of 3,4-dichlorobenzoate (CHEBI:83287) IUPAC Name 3,4-dichlorobenzoate Registry Number Type Source 3665338 Reaxys Registry Number Reaxys Last Modified 13 October 2014