Consensus flow list

Identity

Type
Chemical salt
CAS
650-51-1
EC
211-479-2
Origin
EF 3.1 hybrid_name_cas_v1
Changes
59 across every transformer

Structure

Structure diagram for TCA

Alternative labels

15

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string SAQSTQBVENFSKT-UHFFFAOYSA-M
InChI2D string chemrof:inchi2d_string InChI=1S/C2HCl3O2.Na/c3-2(4,5)1(6)7;/h(H,6,7);/q;+1/p-1
IUPAC name chemrof:IUPAC_name Acetic acid, 2,2,2-trichloro-, sodium salt (1:1)
Molecular formula chemrof:molecular_formula C2Cl3NaO2, C2Cl3O2.Na
Molecular mass chemrof:molecular_mass 185.369
Monoisotopic mass chemrof:monoisotopic_mass 183.886157, 183.88616
SMILES string chemrof:smiles_string O=C([O-])C(Cl)(Cl)Cl.[Na+]

Known URLs

14

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource URL Recorded by
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=650-51-1 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:81976 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.010.437 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=1139 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID6034924 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL2028283 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/2N76A3BRJ0 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J74.800E enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C18808 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C18808 enrich_references.pubchem_identifier_url
ppdb ppdb:609 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/23681045 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q1856343 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Sodium_trichloroacetate enrich_references.pubchem_identifier_url

Elementary flows

14
Flow Context Source Unit CFs
28d99c81-f3f7-4e6f-a4c1-d81455b99719 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
bf325713-7556-4596-bd7a-02133c446b52 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
55fb82c2-0480-495a-925b-f06ed2e3db47 Environmental → Air → Indoor EF 3.1 kg 4
ba1ce37a-4897-4c97-9438-e9abeb8505f9 Environmental → Air → Long-term EF 3.1 kg 0
06ed9b16-fc4b-4411-9549-6a37f4a438b1 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
9b098dae-6ced-4d7e-85b7-e56d9780f177 Environmental → Air → Unknown EF 3.1 kg 4
f1d31e70-d284-40b4-b775-148e1c807608 Environmental → Ground → Agricultural EF 3.1 kg 4
503ed20d-669e-479d-8286-7e599165ca6d Environmental → Ground → Non-agricultural EF 3.1 kg 4
ca2f1874cf2ba6edee909c82a0668f92007a0eae Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
042c7715-0d6b-43b4-a0f7-43b2fd8cb88f Environmental → Ground → Unknown EF 3.1 kg 4
e6fc1373-3db9-4141-9b6c-9b6606fdfb0e Environmental → Water → Long-term EF 3.1 kg 0
4868b441-2a6e-4c70-825b-f4628e374ed5 Environmental → Water → Ocean EF 3.1 kg 4
90765d4c-ac48-4dcb-8b8c-161f9468981a Environmental → Water → Surface water EF 3.1 kg 4
9abe9a8e-66d0-4479-a100-5668c3a50ce6 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (59 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-79115a923d4ac657",
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    {
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        "prov:wasDerivedFrom": "legacy name field"
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  ],
  "altLabel": [
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    {
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    },
    {
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      "@value": "Drimarene Salt FD",
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    {
      "@value": "NaTa",
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      "@value": "Remazol Salt FD",
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    },
    {
      "@value": "Sodium TCA",
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    },
    {
      "@value": "Sodium trichloroacetate",
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    },
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