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> Main
CHEBI:30801 - terephthalate(1−)
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ChEBI Ontology
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ChEBI Name
terephthalate(1−)
ChEBI ID
CHEBI:30801
ChEBI ASCII Name
terephthalate(1-)
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C8H5O4
Net Charge
-1
Average Mass
165.12290
Monoisotopic Mass
165.01933
InChI
InChI=1S/C8H6O4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h1-4H,(H,9,10)(H,11,12)/p-1
InChIKey
KKEYFWRCBNTPAC-UHFFFAOYSA-M
SMILES
OC(=O)c1ccc(cc1)C([O-])=O
ChEBI Ontology
Outgoing
terephthalate(1−) (
CHEBI:30801
)
is a
dicarboxylic acid monoanion (
CHEBI:35695
)
terephthalate(1−) (
CHEBI:30801
)
is conjugate acid of
terephthalate(2−) (
CHEBI:30043
)
terephthalate(1−) (
CHEBI:30801
)
is conjugate base of
terephthalic acid (
CHEBI:15702
)
Incoming
terephthalic acid (
CHEBI:15702
)
is conjugate acid of
terephthalate(1−) (
CHEBI:30801
)
terephthalate(2−) (
CHEBI:30043
)
is conjugate base of
terephthalate(1−) (
CHEBI:30801
)
IUPAC Name
4-carboxybenzoate
Synonym
Source
hydrogen terephthalate
ChEBI
Registry Numbers
Types
Sources
328026
Gmelin Registry Number
Gmelin
3590108
Beilstein Registry Number
Beilstein
Last Modified
09 September 2008