Consensus flow list

Identity

Type
NeutralMolecule
CAS
98-56-6
EC
202-681-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 1-chloro-4-(trifluoromethyl)benzene

Alternative labels

17

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string QULYNCCPRWKEMF-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C7H4ClF3/c8-6-3-1-5(2-4-6)7(9,10)11/h1-4H
IUPAC name chemrof:IUPAC_name 1-chloro-4-(trifluoromethyl)benzene
Molecular formula chemrof:molecular_formula C7H4ClF3
Molecular mass chemrof:molecular_mass 180.556
Monoisotopic mass chemrof:monoisotopic_mass 179.995362
SMILES string chemrof:smiles_string FC(F)(F)c1ccc(Cl)cc1

Known URLs

13

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=98-56-6 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.002.438 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.207.883 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID7024821 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=10309 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1797001 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/694YO34JHC enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0246394 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J31.775F enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/7394 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#2234 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q410670 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/4-Chlorobenzotrifluoride enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
33e8374e-7ea5-4ba1-8f32-bcd472aa91bd Environmental → Air → Aircraft cruise height EF 3.1 kg 2
2e953c11-c729-43e6-ae30-dbd04c77fdd5 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
8402b9d3-2822-4d2d-a6cc-474d7ef0e10d Environmental → Air → Indoor EF 3.1 kg 2
691c23eb-61b8-43c0-ac83-61f5853c1618 Environmental → Air → Long-term EF 3.1 kg 0
2a6626f9-605b-43fe-acf6-7a30af2dcc40 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
859ce717-3331-436b-a809-103598495b99 Environmental → Air → Unknown EF 3.1 kg 2
425b5977-e124-4593-8969-713a0ffb68e9 Environmental → Ground → Agricultural EF 3.1 kg 2
ad488454-dfa1-428b-bc86-ea0030c1684e Environmental → Ground → Non-agricultural EF 3.1 kg 2
b6e2248f-ce0a-4ce3-9c87-b6921cb17cdd Environmental → Ground → Unknown EF 3.1 kg 2
560fd19f-f8ca-4fb1-9954-efbff14ef650 Environmental → Water → Long-term EF 3.1 kg 0
a84bb21f-393c-4f54-bf4c-b6a976d07577 Environmental → Water → Ocean EF 3.1 kg 2
dd02d870-7cbd-4087-ba74-2ea2c39aa6ba Environmental → Water → Surface water EF 3.1 kg 2
4250a86a-56f4-4d87-9c52-008fd4edf3c1 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-53259a7aa1528d51",
  "prefLabel": [
    {
      "@value": "1-chloro-4-(trifluoromethyl)benzene",
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        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "(p-Chlorophenyl)trifluoromethane",
      "@language": "en",
      "@lang": "en",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "4-(Trifluoromethyl)chlorobenzene",
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    },
    {
      "@value": "4-(Trifluoromethyl)phenyl chloride",
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    },
    {
      "@value": "4-Chloro(trifluoromethyl)benzene",
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    },
    {
      "@value": "4-Chloro-1-trifluoromethylbenzene",
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    },
    {
      "@value": "4-Chloro-α,α,α-benzotrifluoride",
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    },
    {
      "@value": "4-Chloro-α,α,α-trifluorotoluene",
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    {
      "@value": "4-Chlorobenzyltrifluoride",
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    {
      "@value": "4-Trifluoromethyl-1-chlorobenzene",
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    {
      "@value": "Benzene, 1-chloro-4-(trifluoromethyl)-",
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    {
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    },
    {
      "@value": "p-Trifluoromethylphenyl chloride",
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    },
    {
      "@value": "Toluene, p-chloro-α,α,α-trifluoro-",
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  "properties": {
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