Consensus flow list

Identity

Type
Neutral molecule
CAS
132-65-0
EC
205-072-9
Origin
EF 3.1 hybrid_name_cas_v1
Changes
57 across every transformer

Structure

Structure diagram for Dibenzothiophene

Alternative labels

8

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string IYYZUPMFVPLQIF-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C12H8S/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-8H
IUPAC name chemrof:IUPAC_name Dibenzothiophene
Molecular formula chemrof:molecular_formula C12H8S
Molecular mass chemrof:molecular_mass 184.263
Monoisotopic mass chemrof:monoisotopic_mass 184.03467, 184.034671
SMILES string chemrof:smiles_string c1ccc2c(c1)sc1ccccc12

Known URLs

28

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=132-65-0 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:23681 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.004.613 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID0047741 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=2843 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=756732 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL219828 enrich_references.pubchem_identifier_url
gmelin gmelin:83631 enrich_references.chebi_xrefs
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/Z3D4AJ1R48 enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0251165 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.523B enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/D03777 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C20125 enrich_references.pubchem_identifier_url
kegg.jp https://www.kegg.jp/entry/D03777 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=53911 enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C47484 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/3023 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=018352 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/15092946 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/16232582 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/16268154 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/16391083 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/17616875 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/21750993 enrich_references.chebi_xrefs
reaxys reaxys:121101 enrich_references.chebi_xrefs
umbbd.compound umbbd.compound:c0118 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q544767 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Dibenzothiophene enrich_references.chebi_xrefs

Elementary flows

13
Flow Context Source Unit CFs
72929e1f-f04f-40e9-a285-671205675695 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
9929392b-57dd-422c-ba9f-9359773383d0 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
e06259eb-e61c-4a30-8369-4caf7aeab6db Environmental → Air → Indoor EF 3.1 kg 2
1d89a639-5609-4e19-9bfb-0775a966bdc3 Environmental → Air → Long-term EF 3.1 kg 0
883b1d9d-c24e-4389-aa13-28e80532d004 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
836f270d-431e-4b3f-81bf-1ab5dda7968a Environmental → Air → Unknown EF 3.1 kg 2
d592047b-2bc4-49e8-81e1-2856eb170ff5 Environmental → Ground → Agricultural EF 3.1 kg 2
3a031809-06f1-42fc-a41d-75d150ed8056 Environmental → Ground → Non-agricultural EF 3.1 kg 2
bfb265ef-fcde-4a88-aba4-0ac284138208 Environmental → Ground → Unknown EF 3.1 kg 2
fdb13a4a-e80b-4565-b20c-76080bf17e4f Environmental → Water → Long-term EF 3.1 kg 0
22ac6509-c517-4ae5-8f73-8ebcef5b7125 Environmental → Water → Ocean EF 3.1 kg 2
8347f066-8271-42c1-9350-bfae9d5586c9 Environmental → Water → Surface water EF 3.1 kg 2
c2ab502f-eb8d-47de-ad6e-4114e8aacc27 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (57 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-86e9d1f727be390e",
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  "altLabel": [
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      "@value": "2,2′-Biphenylylene sulfide",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
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    },
    {
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    },
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  "properties": {
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