Consensus flow list

Identity

Type
Neutral molecule
CAS
363-17-7
EC
632-237-6
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for N-(2-fluorenyl)-2,2,2-trifluoroacetamide

Alternative labels

3

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string XPHPBNGAXWJHHP-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C15H10F3NO/c16-15(17,18)14(20)19-11-5-6-13-10(8-11)7-9-3-1-2-4-12(9)13/h1-6,8H,7H2,(H,19,20)
IUPAC name chemrof:IUPAC_name N-(2-fluorenyl)-2,2,2-trifluoroacetamide
Molecular formula chemrof:molecular_formula C15H10F3NO
Molecular mass chemrof:molecular_mass 277.245
Monoisotopic mass chemrof:monoisotopic_mass 277.071449
SMILES string chemrof:smiles_string O=C(Nc1ccc2c(c1)Cc1ccccc1-2)C(F)(F)F

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=363-17-7 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.160.410 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID3020629 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=12283 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL82129 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/454X3J3CX8 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J33.421I enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/9690 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q63088208 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
04206e64-6556-11dd-ad8b-0800200c9a66 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
fe0acd60-3ddc-11dd-ad3b-0050c2490048 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
11a99770-d220-41f3-b566-ddf4ab51ae16 Environmental → Air → Indoor EF 3.1 kg 2
fe0acd60-3ddc-11dd-ad3a-0050c2490048 Environmental → Air → Long-term EF 3.1 kg 0
fe0acd60-3ddc-11dd-ad3c-0050c2490048 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
fe0acd60-3ddc-11dd-ad39-0050c2490048 Environmental → Air → Unknown EF 3.1 kg 2
fe0acd60-3ddc-11dd-ad37-0050c2490048 Environmental → Ground → Agricultural EF 3.1 kg 2
fe0acd60-3ddc-11dd-ad40-0050c2490048 Environmental → Ground → Non-agricultural EF 3.1 kg 2
fe0acd60-3ddc-11dd-ad38-0050c2490048 Environmental → Ground → Unknown EF 3.1 kg 2
fe0acd60-3ddc-11dd-ad3e-0050c2490048 Environmental → Water → Long-term EF 3.1 kg 0
fe0acd60-3ddc-11dd-ad41-0050c2490048 Environmental → Water → Ocean EF 3.1 kg 2
fe0acd60-3ddc-11dd-ad3d-0050c2490048 Environmental → Water → Surface water EF 3.1 kg 2
fe0acd60-3ddc-11dd-ad3f-0050c2490048 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-94313d987fb3843f",
  "prefLabel": [
    {
      "@value": "N-(2-fluorenyl)-2,2,2-trifluoroacetamide",
      "@language": "en",
      "@lang": "en",
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      }
    }
  ],
  "altLabel": [
    {
      "@value": "Acetamide, N-9H-fluoren-2-yl-2,2,2-trifluoro-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Acetamide, N-fluoren-2-yl-2,2,2-trifluoro-",
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      }
    },
    {
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    "https://w3id.org/chemrof/monoisotopic_mass": {
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}

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