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CHEBI:166849 - 3,4,5-trichlorobenzoic acid
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ChEBI Name
3,4,5-trichlorobenzoic acid
ChEBI ID
CHEBI:166849
Definition
A chlorobenzoic acid that is benzoic acid in which the ring hydrogens at positions 3,4 and 5 are substituted by chloro groups.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Elad Noor
Supplier Information
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Molfile
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Molfile
Formula
C7H3Cl3O2
Net Charge
0
Average Mass
225.450
Monoisotopic Mass
223.91986
InChI
InChI=1S/C7H3Cl3O2/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2H,(H,11,12)
InChIKey
ICUICNRYLHKQGS-UHFFFAOYSA-N
SMILES
OC(=O)C1=CC(Cl)=C(Cl)C(Cl)=C1
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
3,4,5-trichlorobenzoic acid (
CHEBI:166849
)
is a
chlorobenzoic acid (
CHEBI:23134
)
3,4,5-trichlorobenzoic acid (
CHEBI:166849
)
is a
trichlorobenzene (
CHEBI:27096
)
IUPAC Name
3,4,5-trichlorobenzoic acid
Synonyms
Sources
3,4,5-trichloro-benzoic acid
ChEBI
benzoic acid, 3,4,5-trichloro-
ChemIDplus
Manual Xref
Database
5607
ChemSpider
View more database links
Registry Numbers
Types
Sources
3267440
Reaxys Registry Number
Reaxys
51-39-8
CAS Registry Number
ChemIDplus
Last Modified
16 November 2020