1,2,3-benzenetricarboxylic acid (Q27070757)

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chemical compound

• 1,2,3-benzenetricarboxylate
• hemimellitic acid

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Language	Label	Description	Also known as
English	1,2,3-benzenetricarboxylic acid	chemical compound	1,2,3-benzenetricarboxylate hemimellitic acid

Statements

instance of

type of chemical entity

0 references

subclass of

chemical compound

0 references

chemical structure

1,2,3-Benzoltricarbonsäure.svg
310 × 330; 8 KB

0 references

mass

210.016±0 dalton

1 reference

stated in

PubChem

PubChem CID

11288

language of work or name

English

title

1,2,3-Benzenetricarboxylic acid (English)

retrieved

19 October 2016

chemical formula

C₉H₆O₆

1 reference

stated in

PubChem

PubChem CID

11288

language of work or name

English

title

1,2,3-Benzenetricarboxylic acid (English)

retrieved

19 October 2016

canonical SMILES

C1=CC(=C(C(=C1)C(=O)O)C(=O)O)C(=O)O

1 reference

stated in

PubChem

PubChem CID

11288

language of work or name

English

title

1,2,3-Benzenetricarboxylic acid (English)

retrieved

19 October 2016

Commons category

Hemimellitic acid

0 references

Identifiers

InChI

InChI=1S/C9H6O6/c10-7(11)4-2-1-3-5(8(12)13)6(4)9(14)15/h1-3H,(H,10,11)(H,12,13)(H,14,15)

1 reference

stated in

PubChem

PubChem CID

11288

language of work or name

English

title

1,2,3-Benzenetricarboxylic acid (English)

retrieved

19 October 2016

InChIKey

UJMDYLWCYJJYMO-UHFFFAOYSA-N

1 reference

stated in

PubChem

PubChem CID

11288

language of work or name

English

title

1,2,3-Benzenetricarboxylic acid (English)

retrieved

19 October 2016

CAS Registry Number

569-51-7

2 references

stated in

Global Substance Registration System

UNII

CKU8PTZ7M8

language of work or name

English

title

1,2,3-benzenetricarboxylic acid (English)

retrieved

19 October 2016

InChIKey

UJMDYLWCYJJYMO-UHFFFAOYSA-N

stated in

CAS Common Chemistry

retrieved

9 April 2021

reference URL

https://commonchemistry.cas.org/detail?cas_rn=569-51-7

ChemSpider ID

10814

1 reference

stated in

ChemSpider

ChemSpider ID

10814

language of work or name

English

title

HEMIMELLITIC ACID (English)

retrieved

19 October 2016

PubChem CID

11288

2 references

stated in

PubChem

PubChem CID

11288

language of work or name

English

title

1,2,3-Benzenetricarboxylic acid (English)

retrieved

19 October 2016

matched by identifier from

InChIKey

InChIKey

UJMDYLWCYJJYMO-UHFFFAOYSA-N

ChEMBL ID

CHEMBL1161013

1 reference

stated in

ChEMBL

ChEMBL ID

CHEMBL1161013

language of work or name

English

title

CHEMBL1161013 (English)

retrieved

19 October 2016

SureChEMBL ID

SCHEMBL23288

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

UJMDYLWCYJJYMO-UHFFFAOYSA-N

UniChem compound ID

144168

1 reference

stated in

UniChem

NMRShiftDB structure ID

20039627

1 reference

matched by identifier from

InChIKey

InChIKey

UJMDYLWCYJJYMO-UHFFFAOYSA-N

DSSTox substance ID

DTXSID901018142

1 reference

matched by identifier from

InChIKey

InChIKey

UJMDYLWCYJJYMO-UHFFFAOYSA-N

DSSTOX compound identifier

DTXCID701486

0 references

NSC number

401092

0 references

EC number

209-317-0

1 reference

stated in

Global Substance Registration System

UNII

CKU8PTZ7M8

language of work or name

English

title

1,2,3-benzenetricarboxylic acid (English)

retrieved

19 October 2016

ECHA Substance Infocard ID

100.008.471

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.008.471

retrieved

27 December 2018

title

Benzene-1,2,3-tricarboxylic acid (English)

quotation

CAS no.: 569-51-7 (English)

Guide to Pharmacology Ligand ID

4701

1 reference

stated in

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

4701

language of work or name

English

title

1,2,3-benzenetricarboxylic acid (English)

retrieved

19 October 2016

Human Metabolome Database ID

HMDB0248978

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

UJMDYLWCYJJYMO-UHFFFAOYSA-N

UNII

CKU8PTZ7M8

2 references

stated in

Global Substance Registration System

UNII

CKU8PTZ7M8

language of work or name

English

title

1,2,3-benzenetricarboxylic acid (English)

retrieved

19 October 2016

matched by identifier from

InChIKey

InChIKey

UJMDYLWCYJJYMO-UHFFFAOYSA-N

Probes And Drugs ID

PD051925

0 references

PDB ligand ID

3GQ

0 references

Google Knowledge Graph ID

/g/11bwdvq_74

0 references

PDB structure ID

4R3N

1 reference

stated in

Protein Data Bank

PDB structure ID

4R3N

language of work or name

English

title

4R3N (English)

retrieved

19 October 2016

4R3W

1 reference

stated in

Protein Data Bank

PDB structure ID

4R3W

language of work or name

English

title

4R3W (English)

retrieved

19 October 2016

 

Sitelinks

Wikipedia(6 entries)

edit

• cswiki Kyselina hemimellitová
• dewiki Hemimellitsäure
• enwiki Hemimellitic acid
• itwiki Acido emimellitico
• kowiki 헤미멜리트산
• zhwiki 连苯三甲酸

Wikibooks(0 entries)

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Wikinews(0 entries)

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Wikiquote(0 entries)

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Wikisource(0 entries)

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Wikiversity(0 entries)

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Wikivoyage(0 entries)

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Wiktionary(0 entries)

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Multilingual sites(1 entry)

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• commonswiki Category:Hemimellitic acid

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