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terephthalate

Properties

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Occurences in reactions

MNX_ID

MNXM2734

	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	0

formula

C₈H₄O₄

charge

-2

mass

164.01206

reference

chebi:30043

InChIKey

KKEYFWRCBNTPAC-UHFFFAOYSA-L

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-2

SMILES

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

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:30043 chebi:30043	terephthalate 1,4-benzenedicarboxylate 1,4-benzenedicarboxylic acid, ion(2-) benzene-1,4-dicarboxylate terephthalate(2-)
envipath:...76efe66b1be1 envipathM:...76efe66b1be1	Terephthalate
seed.compound:cpd03778 seedM:cpd03778	Terephthalate 1,4-Benzenedicarboxylic acid 1,4-bezenedicarboxylic acid 1,4-dicarboxybenzene Terephthalic acid p-phthalic acid terephthalate terephthalic acid
sabiork.compound:8555 sabiorkM:8555	Terephthalate 1,4-Benzenedicarboxylic acid Benzene 1,4-dicarboxylate Terephthalic acid
kegg.compound:C06337 keggC:C06337	Terephthalate 1,4-Benzenedicarboxylic acid Terephthalic acid
hmdb:HMDB0002428	Terephthalic acid 1,4-Benzenedicarboxylate 1,4-Benzenedicarboxylic acid Benzene-p-dicarboxylate Benzene-p-dicarboxylic acid Disodium terephthalate Kyselina terftalova Para-benzenedicarboxylate Para-benzenedicarboxylic acid TPA Terephthalate benzene-1,4-dicarboxylic acid p-Benzenedicarboxylate p-Benzenedicarboxylic acid p-Dicarboxybenzene p-Phthalate p-Phthalic acid p-Phthelate p-Phthelic acid terephthalic acid
envipath:...8f71620776ea envipathM:...8f71620776ea envipath:...73a3238f412c envipathM:...73a3238f412c	compound 0058447
CHEBI:30801 chebi:30801	terephthalate(1-) 4-carboxybenzoate hydrogen terephthalate
metacyc.compound:TEREPHTHALATE metacycM:TEREPHTHALATE	terephthalate 1,4-bezenedicarboxylic acid 1,4-dicarboxybenzene TPA p-phthalic acid terephthalic acid
envipath:...bec2875118c7 envipathM:...bec2875118c7 envipath:...a3e7e4cc8fcc envipathM:...a3e7e4cc8fcc	terephthalic acid
CHEBI:15702 chebi:15702	terephthalic acid 1,4-Benzenedicarboxylic acid TPA Terephthalic acid benzene-1,4-dicarboxylic acid p-benzenedicarboxylic acid para-benzenedicarboxylic acid
hmdb:HMDB0061917 hmdb:HMDB02428 hmdb:HMDB61917 chebi:15211 chebi:26868 chebi:26870 chebi:9452 keggC:M_C06337 seedM:M_cpd03778	secondary/obsolete/fantasy identifier