Consensus flow list

Identity

Type
Neutral molecule
CAS
1835-49-0
EC
217-397-3
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Tetrafluoroterephthalonitrile

Alternative labels

12

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string PCRSJGWFEMHHEW-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C8F4N2/c9-5-3(1-13)6(10)8(12)4(2-14)7(5)11
IUPAC name chemrof:IUPAC_name Tetrafluoroterephthalonitrile
Molecular formula chemrof:molecular_formula C8F4N2
Molecular mass chemrof:molecular_mass 200.094
Monoisotopic mass chemrof:monoisotopic_mass 199.999761
SMILES string chemrof:smiles_string N#Cc1c(F)c(F)c(C#N)c(F)c1F

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=1835-49-0 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.015.816 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID1075141 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=97007 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3248223 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/K9NAY7JK97 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.782E enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/15783 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q72505256 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
e82a3236-4719-4527-93ee-bc032e483da7 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
43c42ea3-c85b-4393-8103-29d9258a7f1c Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
fb50a136-a69d-446f-a2c1-fab11d51d755 Environmental → Air → Indoor EF 3.1 kg 2
420bd4b2-29b4-42f3-a17b-0dbc5ba2624f Environmental → Air → Long-term EF 3.1 kg 0
a3fb2041-03dc-45f3-a321-329dc4b56fae Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
d222a51f-7960-4c6a-b60a-9de71c4c7293 Environmental → Air → Unknown EF 3.1 kg 2
a0bdba62-6c74-44ef-a033-c24cb59bcc63 Environmental → Ground → Agricultural EF 3.1 kg 2
8057b99d-e7c2-4c84-92e5-4dedf2edf396 Environmental → Ground → Non-agricultural EF 3.1 kg 2
f79c6176-ff90-4f90-ae69-a52ca4f9deb4 Environmental → Ground → Unknown EF 3.1 kg 2
3c6218bc-a27c-4322-bd94-1eedf6639015 Environmental → Water → Long-term EF 3.1 kg 0
feaf56e1-1675-4df2-90ef-77c5eb6b7186 Environmental → Water → Ocean EF 3.1 kg 2
c119de23-98a9-4702-b04a-d7758560a82e Environmental → Water → Surface water EF 3.1 kg 2
b65835b0-0df1-41ad-8d81-3b730fba7d54 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
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    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ]
}

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