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InChI=1S/CH4O/c1-2/h2H,1H3
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CHEBI:30803 - isophthalate(2−)
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ChEBI Ontology
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ChEBI Name
isophthalate(2−)
ChEBI ID
CHEBI:30803
ChEBI ASCII Name
isophthalate(2-)
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C8H4O4
Net Charge
-2
Average Mass
164.11496
Monoisotopic Mass
164.01206
InChI
InChI=1S/C8H6O4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H,(H,9,10)(H,11,12)/p-2
InChIKey
QQVIHTHCMHWDBS-UHFFFAOYSA-L
SMILES
[O-]C(=O)c1cccc(c1)C([O-])=O
ChEBI Ontology
Outgoing
isophthalate(2−) (
CHEBI:30803
)
is a
dicarboxylic acid dianion (
CHEBI:28965
)
isophthalate(2−) (
CHEBI:30803
)
is conjugate base of
isophthalate(1−) (
CHEBI:30804
)
Incoming
isophthalate(1−) (
CHEBI:30804
)
is conjugate acid of
isophthalate(2−) (
CHEBI:30803
)
IUPAC Name
benzene-1,3-dicarboxylate
Synonyms
Sources
1,3-benzenedicarboxylate
ChEBI
isophthalate
UniProt
isophthalate
IUPAC
Registry Numbers
Types
Sources
328933
Gmelin Registry Number
Gmelin
3906186
Beilstein Registry Number
Beilstein
Last Modified
24 May 2019