TCA
fo-79115a923d4ac657
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
Alternative labels
15- Acetic acid, 2,2,2-trichloro-, sodium salt (1:1)
- Acetic acid, trichloro-, sodium salt
- Antiperz
- Antyperz
- Drimarene Salt FD
- NaTa
- Remazol Salt FD
- Sodium TCA
- Sodium trichloroacetate
- STCA
- TCA sodium salt
- TCAN
- Trichloroacetic acid sodium
- Trichloroacetic acid sodium salt
- Varitox
Properties
| Property | Value |
|---|---|
| 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
14Where 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 | 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)
Full record
Flow object JSON
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Something wrong here?
- This substance is published under the wrong name
- This is not that chemical
- This record is two substances, or it is a second copy of one
You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works