Consensus flow list

1-λ1-oxidanyl-2,2,6,6-tetramethylpiperidin-4-ol

fo-1b8f807bab4e81cd

Identity

Type
NeutralMolecule
CAS
2226-96-2
EC
218-760-9
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 1-λ1-oxidanyl-2,2,6,6-tetramethylpiperidin-4-ol

Alternative labels

81

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string UZFMOKQJFYMBGY-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C9H18NO2/c1-8(2)5-7(11)6-9(3,4)10(8)12/h7,11H,5-6H2,1-4H3
Molecular formula chemrof:molecular_formula C9H18NO2
Molecular mass chemrof:molecular_mass 172.248
Monoisotopic mass chemrof:monoisotopic_mass 172.13375, 172.133754
SMILES string chemrof:smiles_string CC1(C)CC(O)CC(C)(C)N1[O]

Known URLs

41

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=2226-96-2 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:180664 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.017.056 enrich_references.pubchem_identifier_url
ChemSpider https://www.chemspider.com/Chemical-Structure.121639.html enrich_references.chebi_xrefs
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID4041280 enrich_references.pubchem_identifier_url
DrugBank https://go.drugbank.com/drugs/DB12449 enrich_references.chebi_xrefs
drugbank.ca https://www.drugbank.ca/drugs/DB12449 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL607023 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/U78ZX2F65X enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0258807 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J119.381C enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=153436 enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C96428 enrich_references.pubchem_identifier_url
platform.opentargets.org https://platform.opentargets.org/drug/CHEMBL607023 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/137994 enrich_references.pubchem_compound
PubMed https://pubmed.ncbi.nlm.nih.gov/24769526 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/2610866 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/27044831 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/28320189 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/28714295 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/30549080 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/30924375 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/31504248 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/31825758 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/32366855 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/32573229 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/32726580 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/33061560 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/33078650 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/33098599 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/33467068 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/33669093 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/34248639 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/34290305 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/34425240 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/34522067 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/34630119 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/34632934 enrich_references.chebi_xrefs
reaxys reaxys:11328213 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q4637150 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/4-Hydroxy-TEMPO enrich_references.chebi_xrefs

Elementary flows

13
Flow Context Source Unit CFs
4020a27c-490c-4d3b-a1c8-58eea58ef378 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
c2163ee1-d8fd-4650-b152-4d0fcbe7b040 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
92f9d00d-6919-4b07-b20b-d710aac925c9 Environmental → Air → Indoor EF 3.1 kg 4
88a70127-69e3-43b4-ab4a-5400bcc52e06 Environmental → Air → Long-term EF 3.1 kg 0
45acbf21-9b31-4203-a000-5a6fb49d862a Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
bc45c364-b38e-4995-a1e9-316abac8051f Environmental → Air → Unknown EF 3.1 kg 4
c03dfe17-d537-47bb-95d7-764f79ec0a1e Environmental → Ground → Agricultural EF 3.1 kg 4
b8c1dc28-fa80-45c6-acf2-faf56920d73e Environmental → Ground → Non-agricultural EF 3.1 kg 4
32e83125-4fbc-4c91-b467-bd573075e73c Environmental → Ground → Unknown EF 3.1 kg 4
6f74cc20-2c5d-4b90-8345-dd1a98486b5f Environmental → Water → Long-term EF 3.1 kg 0
6f84f5b9-d0dc-47ed-b318-02d44c753720 Environmental → Water → Ocean EF 3.1 kg 4
2d573f71-616b-403c-ba21-d39cfcca8333 Environmental → Water → Surface water EF 3.1 kg 4
d1300cb9-8648-4c14-861d-9bdd06e4940c Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-1b8f807bab4e81cd",
  "prefLabel": [
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      "@value": "1-λ1-oxidanyl-2,2,6,6-tetramethylpiperidin-4-ol",
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        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)oxidanyl",
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    },
    {
      "@value": "1-Oxyl-2,2,6,6-tetramethyl-4-hydroxypiperidine",
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    },
    {
      "@value": "1-Oxyl-2,2,6,6-tetramethyl-4-piperidinol",
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      }
    },
    {
      "@value": "1-Piperidinyloxy, 4-hydroxy-2,2,6,6-tetramethyl-",
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      }
    },
    {
      "@value": "2,2,6,6-tetramethyl-1-oxy-4-hydroxypiperidine",
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    },
    {
      "@value": "2,2,6,6-Tetramethyl-4-hydroxylpiperidine-1-oxyl",
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    {
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    },
    {
      "@value": "2,2,6,6-tetramethyl-4-hydroxypiperidine 1-oxide radical",
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    },
    {
      "@value": "2,2,6,6-Tetramethyl-4-hydroxypiperidine N-oxide",
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    },
    {
      "@value": "2,2,6,6-Tetramethyl-4-hydroxypiperidine oxide",
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    },
    {
      "@value": "2,2,6,6-Tetramethyl-4-hydroxypiperidine-1-hydroxyl",
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    },
    {
      "@value": "2,2,6,6-tetramethyl-4-hydroxypiperidine-1-oxyl",
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    },
    {
      "@value": "2,2,6,6-tetramethyl-4-hydroxypiperidinooxy",
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    {
      "@value": "2,2,6,6-tetramethyl-4-hydroxypiperidinooxy radical",
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      }
    },
    {
      "@value": "2,2,6,6-Tetramethyl-4-hydroxypiperidinyl-1-oxy",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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      }
    },
    {
      "@value": "2,2,6,6-Tetramethyl-4-hydroxypiperidinyl-1-oxyl",
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      }
    },
    {
      "@value": "2,2,6,6-Tetramethyl-4-hydroxypiperidinyloxy radical",
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      }
    },
    {
      "@value": "2,2,6,6-Tetramethyl-4-hydroxypiperidinyloxyl radical",
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      }
    },
    {
      "@value": "2,2,6,6-tetramethyl-4-hydroxypiperidyl 1-oxyl",
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      }
    },
    {
      "@value": "2,2,6,6-tetramethyl-4-oxypiperidine-1-oxyl",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "2,2,6,6-tetramethyl-4-piperidinol 1-oxide",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "2,2,6,6-tetramethyl-4-piperidinol 1-oxyl",
      "@language": "en",
      "@lang": "en",
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "2,2,6,6-tetramethyl-4-piperidinol N-oxyl",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "2,2,6,6-tetramethyl-4-piperidinol nitroxide",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "2,2,6,6-tetramethyl-4-piperidinol-1-oxy",
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      "@lang": "en",
      "provenance": {
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      }
    },
    {
      "@value": "2,2,6,6-tetramethyl-4-piperidinol-1-oxyl radical",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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      }
    },
    {
      "@value": "2,2,6,6-Tetramethylpiperidine-4-hydroxy-1-oxyl",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2,2,6,6-tetramethylpiperidine-N-oxyl-4-ol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "2,2,6,6-Tetramethylpiperidinol-4-oxyl-1",
      "@language": "en",
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      }
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