Consensus flow list

1,1'-sulfonyldibenzene

fo-d1d6c9fd497e7f70

Identity

Type
NeutralMolecule
CAS
127-63-9
EC
204-853-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for 1,1'-sulfonyldibenzene

Alternative labels

12

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string KZTYYGOKRVBIMI-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C12H10O2S/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H
IUPAC name chemrof:IUPAC_name 1,1'-sulfonyldibenzene
Molecular formula chemrof:molecular_formula C12H10O2S
Molecular mass chemrof:molecular_mass 218.277
Monoisotopic mass chemrof:monoisotopic_mass 218.04015, 218.040151
SMILES string chemrof:smiles_string O=S(=O)(c1ccccc1)c1ccccc1

Known URLs

17

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=127-63-9 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:78360 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.004.413 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID6041892 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=627706 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=6780 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL263327 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/V25W2CFS3M enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0251453 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J5.398H enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/31386 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=005742 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/23535321 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24367520 enrich_references.chebi_xrefs
reaxys reaxys:1910573 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q5279737 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Diphenyl_sulfone enrich_references.chebi_xrefs

Elementary flows

13
Flow Context Source Unit CFs
a36ed107-2444-4fa9-baee-d94fa5a5630e Environmental → Air → Aircraft cruise height EF 3.1 kg 4
beabbbe6-3fcc-456b-9857-9f60893ff4af Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
e52c3f3e-0ce6-4ceb-a3c0-1d81bcf46d3d Environmental → Air → Indoor EF 3.1 kg 4
9c71a64a-25b5-440d-8346-4312e97af01b Environmental → Air → Long-term EF 3.1 kg 0
a62e5db9-5625-4b64-9c2e-2d6e044689f5 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
bcc0b0a0-c7c4-437b-9b45-4396ba01cd78 Environmental → Air → Unknown EF 3.1 kg 4
97d097c9-6a41-4d2f-b9a4-fa4045edbde3 Environmental → Ground → Agricultural EF 3.1 kg 4
8632a6ba-7e1e-42c3-9d26-5d65742a03e5 Environmental → Ground → Non-agricultural EF 3.1 kg 4
9cc38623-2a3d-4e26-90a8-41742e37cbb7 Environmental → Ground → Unknown EF 3.1 kg 4
7f99c1f4-3934-4d76-b70e-bd0c77620ae4 Environmental → Water → Long-term EF 3.1 kg 0
0d38b898-a879-449d-b4f5-1645fa0f708a Environmental → Water → Ocean EF 3.1 kg 4
c72705da-71c2-4e8d-982d-a356073fe2f5 Environmental → Water → Surface water EF 3.1 kg 4
09d3bff9-dfdc-49bd-ad3d-9ae98babfaa5 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON 
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