Home › Entities › halogenated fatty acids › dichloroacetic acid

dichloroacetic acid

chemical compound
Class type of: halogenated fatty acids Q412845

Facts

12 properties
Instance of
type of chemical entity
Subclass of
halogenated fatty acids[4]
Canonical SMILES
C(C(=O)O)(Cl)Cl[2]
Chemical formula
C₂H₂Cl₂O₂[3]
Conjugate base
dichloroacetate[16]
Found in taxon
Asparagopsis taxiformis[8]
Has part(s)
oxygen, carbon, chlorine[5][6][7]
Mass
+127.943[10]
Melting point
+10, +13.5[11][12]
PKa
+1.30[9]
Safety classification and labelling
NFPA 704: Standard System for the Identification of the Hazards of Materials for Emergency Response[17]
Subject has role
male reproductive toxicant, developmental toxicant, carcinogen[13][14][15]
🏷️ Also known as
en DCA en dichloroacetate en dichloroacetic acid en Dichloroacetic Acid en 2,2-dichloroacetic acid en bichloracetic acid en dichloracetic acid ar حمض ثنائي كلورو الأسيتيك de Dichloracetat de Dichlorazetat de Dichloressigsäure de Dichlorethansäure es Acido dicloroacetico es Ácido dicloroacético es Dicloroacetato fa دی‌کلرواستیک اسید fa دی کلرواستیک اسید fi 2,2-dikloorietaanihappo fi 2,2-dikloorietikkahappo fi Dikloorietaanihappo
🔖 Identifiers · 47
OpenAlex ID
C2777616060
CA PROP 65 ID
dichloroacetic-acid
CAMEO Chemicals ID
532
CAS Registry Number
79-43-6
ChEBI ID
36386
ChEMBL ID
CHEMBL13960
ChemSpider ID
10771217
DSSTOX compound identifier
DTXCID20428
DSSTox substance ID
DTXSID2020428
DrugBank ID
DB08809
DrugCentral ID
862
EC number
201-207-0
Show all 47 identifiers +35
ECHA Substance Infocard ID
100.001.098
Freebase ID
/m/08jmfn
Gmelin number
2477
HCIS ID
1267
HSDB ID
6894
ICSC ID
0868
InChI
InChI=1S/C2H2Cl2O2/c3-1(4)2(5)6/h1H,(H,5,6)
InChIKey
JXTHNDFMNIQAHM-UHFFFAOYSA-N
KBpedia ID
DichloroaceticAcid
KEGG ID
C11149
LIPID MAPS ID
LMFA01090070
MassBank accession ID
MSBNK-Keio_Univ-KO000569, MSBNK-Keio_Univ-KO000570, MSBNK-Keio_Univ-KO000571, MSBNK-Keio_Univ-KO000572, MSBNK-Keio_Univ-KO000573, MSBNK-Keio_Univ-KO000684, MSBNK-Keio_Univ-KO000685, MSBNK-Keio_Univ-KO000686, MSBNK-Keio_Univ-KO000687, MSBNK-Keio_Univ-KO000688
MeSH descriptor ID
D003999
MeSH tree code
D02.241.081.018.214.500, D02.455.526.439.196.500
Microsoft Academic ID (discontinued)
2777616060, 2909840573
NDF-RT ID
N0000147360
NMRShiftDB structure ID
10016785
NSC number
2654
OSHA Occupational Chemical Database ID
695
PDB ligand ID
TF4
PDB structure ID
2BU8, 2Q8H
PesticideInfo chemical ID
PRI2599
Probes And Drugs ID
PD003025
PubChem CID
6597
RTECS number
AG6125000
Reaxys registry number
1098596
RxNorm CUI
155021
Römpp online ID
RD-04-01248
SPLASH
splash10-001i-9000000000-cdde3faa793ecb51af1b, splash10-001i-9000000000-c1ded91474fde2787d95, splash10-0019-9000000000-cea4fe3c3f1653aa150d, splash10-000i-9000000000-68d75216c4534c61a4b4, splash10-0059-6900000000-55338ed4fe8335b6f8ba, splash10-001i-9000000000-d0c2081f59cf4a1d9bb9, splash10-001i-9000000000-aa8cfce9c157e8ce5c26, splash10-0019-9000000000-d0fd266005ba1e11af9f, splash10-000i-9000000000-67e8e2a12579c484a9d1
SureChEMBL ID
7777
UM-BBD compound ID
c0012
UMLS CUI
C0600203
UNII
9LSH52S3LQ
UniChem compound ID
10177
ZVG number
24970

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🔗 Connections
Has part(s) 3
oxygen, carbon, chlorine
Found in taxon 1
Asparagopsis taxiformis
Subject has role 1
carcinogen
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Summary

dichloroacetic acid is a type of chemical entity[1].

References

Programmatic citations — every numbered marker resolves to a verifiable graph row below.

Direct Wikidata claims

  1. [2] ↑ . wikidata.org.
  2. [3] ↑ . wikidata.org.
  3. [4] ↑ . wikidata.org.
  4. [5] ↑ . wikidata.org.
  5. [6] ↑ . wikidata.org.
  6. [7] ↑ . wikidata.org.
  7. [8] ↑ . wikidata.org.
  8. [9] ↑ . wikidata.org.
  9. [10] ↑ . wikidata.org.
  10. [11] ↑ . wikidata.org.
  11. [12] ↑ . wikidata.org.
  12. [13] ↑ . wikidata.org.
  13. [14] ↑ . wikidata.org.
  14. [15] ↑ . wikidata.org.
  15. [16] ↑ . wikidata.org.
  16. [17] ↑ . wikidata.org.

Class ancestry

  1. [1] ↑ . Wikidata. wikidata.org.

📑 Cite this page

Use these citations when quoting this entity in research, articles, AI prompts, or wherever provenance matters. We aggregate Wikidata + Wikipedia + authoritative open-data sources; the stitched, scored, cross-referenced view is what 4ort.xyz contributes.

APA 4ort.xyz Knowledge Graph. (2026). dichloroacetic acid. Retrieved November 11, 2026, from https://4ort.xyz/entity/dichloroacetic-acid
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Edit History

Rolling log of changes to this entity's Wikidata record. Values shown reflect the current state of each edited property — follow the history link to see the precise diff for any edit.

  1. 6w ago · KrBot bot · 2026-09-26 view diff on Wikidata ↗
    ZVG number → 24970
    "Changed claim: ZVG number: 24970, см. / see autofix на / on P679"
  2. 7w ago · Mrwdat3 · 2026-09-23 view diff on Wikidata ↗
    ZVG number → 24970
    "Created claim: ZVG number: 024970, batch #275042"
  3. 20w ago · Nabbegat · 2026-06-19 view diff on Wikidata ↗
    Instance of → type of chemical entity
    Safety classification and labelling → NFPA 704: Standard System for the Identification of the Haza
    Found in taxon → Asparagopsis taxiformis
    Subclass of → halogenated fatty acids
    + 7 other properties edited (see Wikidata diff for full list)
    "Changed [tr] labels, descriptions or aliases: QuickStatements 3.0 batch #37300"
Live feed via Wikidata EventStreams. New edits appear within minutes of being made on Wikidata.