Consensus flow list

Identity

Type
Neutral molecule
CAS
675-62-7
EC
211-623-4
Origin
EF 3.1 hybrid_name_cas_v1
Changes
53 across every transformer

Structure

Structure diagram for Dichloro(methyl)(3,3,3-trifluoropropyl)silane

Alternative labels

5

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string OHABWQNEJUUFAV-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C4H7Cl2F3Si/c1-10(5,6)3-2-4(7,8)9/h2-3H2,1H3
IUPAC name chemrof:IUPAC_name bis(chloranyl)-methyl-[3,3,3-tris(fluoranyl)propyl]silane, dichloro-methyl-(3,3,3-trifluoropropyl)silane
Molecular formula chemrof:molecular_formula C4H7Cl2F3Si
Molecular mass chemrof:molecular_mass 211.086
Monoisotopic mass chemrof:monoisotopic_mass 209.964617
SMILES string chemrof:smiles_string C[Si](CCC(F)(F)F)(Cl)Cl

Known URLs

7

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=675-62-7 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.010.568 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID8027290 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/38XGW8M24K enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J205.974F enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/12666 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27256830 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
123d136e-e123-4e74-8a41-5badc6e50861 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
d855f96e-6880-4250-a11f-6adc337d6a57 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
f9d48a0c-403f-4bc1-bc42-7b34cdfadc85 Environmental → Air → Indoor EF 3.1 kg 4
4ce57820-b2a8-4e58-95b2-02d831ba349c Environmental → Air → Long-term EF 3.1 kg 0
3f4f7b65-e2c4-40ee-9f8a-29f3138d05bb Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
43559618-13a6-4a3e-9d3c-ed1933860af8 Environmental → Air → Unknown EF 3.1 kg 4
394f9542-5071-4698-93e4-11c5e7f403ca Environmental → Ground → Agricultural EF 3.1 kg 4
ec8ae2e5-73bb-4456-a46a-2a3f17b4a9c0 Environmental → Ground → Non-agricultural EF 3.1 kg 4
73f5df59-d632-4da5-9b05-0f4fa42772ce Environmental → Ground → Unknown EF 3.1 kg 4
34ccdafa-5860-427f-82bd-b38b4ff35fa2 Environmental → Water → Long-term EF 3.1 kg 0
42e79500-2c81-47e6-b861-637de61f3bec Environmental → Water → Ocean EF 3.1 kg 4
e157d261-c549-433f-a8bf-15e93af9e3d5 Environmental → Water → Surface water EF 3.1 kg 4
9e68b00c-68a9-4cd6-867f-8f1362396b28 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (53 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-e64463cc83387485",
  "prefLabel": [
    {
      "@value": "Dichloro(methyl)(3,3,3-trifluoropropyl)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": "(3,3,3-Trifluoropropyl)dichloromethylsilane",
      "@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=675-62-7"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "(3,3,3-Trifluoropropyl)methyldichlorosilane",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=675-62-7"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Dichloromethyl(3,3,3-trifluoropropyl)silane",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Methyl-3,3,3-trifluoropropyldichlorosilane",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Silane, dichloromethyl(3,3,3-trifluoropropyl)-",
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      "provenance": {
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        ],
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  ],
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        "C4H7Cl2F3Si"
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    },
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    "https://w3id.org/chemrof/inchi2d_string": {
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      ]
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "@value": [
        "bis(chloranyl)-methyl-[3,3,3-tris(fluoranyl)propyl]silane",
        "dichloro-methyl-(3,3,3-trifluoropropyl)silane"
      ],
      "attested_by": {
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    },
    "https://w3id.org/chemrof/molecular_mass": {
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      "rdfs:label": "Molecular mass",
      "@value": [
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      ],
      "provenance": [
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        },
        {
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          ]
        }
      ],
      "attested_by": {
        "211.086": [
          "rdkit_post_consensus",
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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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      "attested_by": {
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          "rdkit_pre_consensus"
        ]
      },
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    }
  },
  "references": [
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  "created_from": {
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    "seed_uuid": "123d136e-e123-4e74-8a41-5badc6e50861",
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    "semantic_typing": {
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  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
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}

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