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Trichloro(octyl)silane

fo-3b8ed5fb0697a82f

Identity

Type
Neutral molecule
CAS
5283-66-9
EC
226-112-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for Trichloro(octyl)silane

Alternative labels

4

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string RCHUVCPBWWSUMC-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C8H17Cl3Si/c1-2-3-4-5-6-7-8-12(9,10)11/h2-8H2,1H3
IUPAC name chemrof:IUPAC_name trichloro(octyl)silane, tris(chloranyl)-octyl-silane
Molecular formula chemrof:molecular_formula C8H17Cl3Si
Molecular mass chemrof:molecular_mass 247.669
Monoisotopic mass chemrof:monoisotopic_mass 246.01651
SMILES string chemrof:smiles_string CCCCCCCC[Si](Cl)(Cl)Cl

Known URLs

9

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=5283-66-9 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.023.739 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID5029269 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL2133549 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/JV18I1WCU8 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J36.484C enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/21354 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#1801 enrich_references.pubchem_identifier_url
Wikidata https://www.wikidata.org/wiki/Q27281708 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
cf93f1a3-f0db-4793-9130-edaec32387c7 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
e62f36be-c556-4a03-a269-aa04e600612c Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
ac795bec-5f6a-478f-bbc1-259846e50b79 Environmental → Air → Indoor EF 3.1 kg 4
1f0c88e3-4c1a-4c76-97d5-48eb8738acc5 Environmental → Air → Long-term EF 3.1 kg 0
00ffb592-9a1f-4719-8916-5a5afeecc04f Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
306f9bef-d49e-4555-b5a3-3db25259742b Environmental → Air → Unknown EF 3.1 kg 4
5f26b8c7-f1c9-4296-aa1a-819f01cb70bb Environmental → Ground → Agricultural EF 3.1 kg 4
029d5e24-b566-4c21-9657-0170ba8733ff Environmental → Ground → Non-agricultural EF 3.1 kg 4
e78b05d7-4daa-44bf-9535-1120e179bc50 Environmental → Ground → Unknown EF 3.1 kg 4
4238bdd5-1a83-46a4-a7a9-eb5d5c68efe1 Environmental → Water → Long-term EF 3.1 kg 0
a863af4f-f175-42ac-8bf0-e557406440ea Environmental → Water → Ocean EF 3.1 kg 4
d3c21415-97f4-46eb-96eb-940b4ea9a0ce Environmental → Water → Surface water EF 3.1 kg 4
ff0015a6-cae3-4077-b57b-b7d6870a06fb 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-3b8ed5fb0697a82f",
  "prefLabel": [
    {
      "@value": "Trichloro(octyl)silane",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "bootstrap_labels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "n-Octyltrichlorosilane",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:5283-66-9",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=5283-66-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Octyltrichlorosilane",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=5283-66-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Silane, trichlorooctyl-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Trichlorooctylsilane",
      "@language": "en",
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      "provenance": {
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
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  ],
  "properties": {
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      "@value": [
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        }
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    },
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      ],
      "attested_by": {
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          ]
        }
      ]
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "@value": [
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      ],
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        ],
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      },
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      "provenance": {
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        "prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
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    },
    "https://w3id.org/chemrof/molecular_mass": {
      "@id": "https://w3id.org/chemrof/molecular_mass",
      "rdfs:label": "Molecular mass",
      "@value": [
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      ],
      "provenance": [
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          "prov:hadPrimarySource": [
            "CCCCCCCC[Si](Cl)(Cl)Cl"
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        },
        {
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          "prov:hadPrimarySource": [
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        }
      ],
      "attested_by": {
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        ]
      },
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
      "@id": "https://w3id.org/chemrof/monoisotopic_mass",
      "rdfs:label": "Monoisotopic mass",
      "@value": [
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      ],
      "provenance": [
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          ]
        },
        {
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          "prov:hadPrimarySource": [
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          ]
        }
      ],
      "attested_by": {
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        ]
      },
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    }
  },
  "references": [
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  "created_from": {
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  "@type": [
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  ]
}

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