Consensus flow list

Identity

Type
Neutral molecule
CAS
56-35-9
EC
200-268-0
Origin
EF 3.1 hybrid_name_cas_v1
Changes
57 across every transformer

Structure

Structure diagram for Tributyltin Oxide

Alternative labels

34

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string APQHKWPGGHMYKJ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/6C4H9.O.2Sn/c6*1-3-4-2;;;/h6*1,3-4H2,2H3;;;
IUPAC name chemrof:IUPAC_name 1,1,1,3,3,3-Hexabutyldistannoxane
Molecular formula chemrof:molecular_formula C24H54OSn2
Molecular mass chemrof:molecular_mass 596.117
Monoisotopic mass chemrof:monoisotopic_mass 598.221856, 598.22186
SMILES string chemrof:smiles_string CCC[CH2][Sn]([CH2]CCC)([CH2]CCC)[O][Sn]([CH2]CCC)([CH2]CCC)[CH2]CCC

Known URLs

17

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=56-35-9 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:81543 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.000.244 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=1282 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID9020166 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=22332 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=28132 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/3353Q84MKM enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J4.568C enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C18149 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C18149 enrich_references.pubchem_identifier_url
ppdb ppdb:2585 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/16682746 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#2788 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#3020 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q384794 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Tributyltin_oxide enrich_references.pubchem_identifier_url

Elementary flows

15
Flow Context Source Unit CFs
d86c61dc-6555-11dd-ad8b-0800200c9a66 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
fe0acd60-3ddc-11dd-a6eb-0050c2490048 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
2927f6d2-766f-4397-b815-fec3d564e4ee Environmental → Air → Indoor EF 3.1 kg 4
fe0acd60-3ddc-11dd-a6ea-0050c2490048 Environmental → Air → Long-term EF 3.1 kg 0
fe0acd60-3ddc-11dd-a6ec-0050c2490048 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
fe0acd60-3ddc-11dd-a473-0050c2490048 Environmental → Air → Unknown EF 3.1 kg 4
fe0acd60-3ddc-11dd-a471-0050c2490048 Environmental → Ground → Agricultural EF 3.1 kg 4
fe0acd60-3ddc-11dd-a6f0-0050c2490048 Environmental → Ground → Non-agricultural EF 3.1 kg 4
ba1a68169d42b0b1b8496bd73d36b22628368fe2 Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
fe0acd60-3ddc-11dd-a472-0050c2490048 Environmental → Ground → Unknown EF 3.1 kg 4
fe0acd60-3ddc-11dd-a6ee-0050c2490048 Environmental → Water → Long-term EF 3.1 kg 0
fe0acd60-3ddc-11dd-a6f1-0050c2490048 Environmental → Water → Ocean EF 3.1 kg 4
2ba96549b3701abb5fee7caafcca2c8c9c2b4520 Environmental → Water → River bafu algorithm addition kg 0
fe0acd60-3ddc-11dd-a6ed-0050c2490048 Environmental → Water → Surface water EF 3.1 kg 4
fe0acd60-3ddc-11dd-a6ef-0050c2490048 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (57 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-cac21be69c8e3329",
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    {
      "@value": "Tributyltin Oxide",
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        "prov:wasDerivedFrom": "legacy name field"
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  ],
  "altLabel": [
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      "@value": "6-Oxa-5,7-distannaundecane, 5,5,7,7-tetrabutyl-",
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      }
    },
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      "@value": "Aceto TBTO",
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    },
    {
      "@value": "BioMeT 66",
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    },
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      "@value": "Bis(tributylstannyl) ether",
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    {
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      "@value": "Butinox",
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      }
    },
    {
      "@value": "Di-tributyl tin oxide",
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    },
    {
      "@value": "Diall",
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    {
      "@value": "Distannoxane, 1,1,1,3,3,3-hexabutyl-",
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    },
    {
      "@value": "Distannoxane, hexabutyl-",
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      }
    },
    {
      "@value": "Hexabutyldistannoxane",
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      }
    },
    {
      "@value": "Hexabutylditin oxide",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Lastanox F",
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      }
    },
    {
      "@value": "Lastanox Q",
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      }
    },
    {
      "@value": "Lastanox Q1",
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      }
    },
    {
      "@value": "Lastanox Super",
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    },
    {
      "@value": "Lastanox T",
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      }
    },
    {
      "@value": "Lastanox T 20",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Mykolastanox F",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Oxybis(tributylstannane)",
      "@language": "en",
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      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Oxybis[tributyltin]",
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          "https://commonchemistry.cas.org/detail?cas_rn=56-35-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Stannicide A",
      "@language": "en",
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      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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          "https://commonchemistry.cas.org/detail?cas_rn=56-35-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Stannicide O",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "TBTO",
      "@language": "en",
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        "prov:wasDerivedFrom": "chebi synonym match"
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    },
    {
      "@value": "TnBTO",
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    },
    {
      "@value": "Tri-n-butyltin oxide",
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      }
    },
    {
      "@value": "Tributyl(tributylstannyloxy)stannane",
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    },
    {
      "@value": "Vikol AF 25",
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    },
    {
      "@value": "Vikol LO 25",
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  ],
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C24H54OSn2"
      ],
      "attested_by": {
        "C24H54OSn2": [
          "enrich_references.chebi_semantic",
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          "rdkit_post_consensus"
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      },
      "rdfs:label": "Molecular formula",
      "provenance": [
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          "prov:wasDerivedFrom": "chebi.basic_property_values.generalized_empirical_formula"
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        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CCC[CH2][Sn]([CH2]CCC)([CH2]CCC)[O][Sn]([CH2]CCC)([CH2]CCC)[CH2]CCC"
          ]
        }
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