Consensus flow list

Identity

Type
Chemical salt
CAS
27344-41-8
EC
248-421-0
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Disodium 2,2'-([1,1'-biphenyl]-4,4'-diyldivinylene)bis(benzenesulphonate)

Alternative labels

37

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string DAPMZWDGZVFZMK-UHFFFAOYSA-N, PMPJQLCPEQFEJW-UHFFFAOYSA-L
InChI2D string chemrof:inchi2d_string InChI=1S/C28H22O6S2.2Na/c29-35(30,31)27-7-3-1-5-25(27)19-13-21-9-15-23(16-10-21)24-17-11-22(12-18-24)14-20-26-6-2-4-8-28(26)36(32,33)34;;/h1-20H,(H,29,30,31)(H,32,33,34);;/q;2*+1/p-2
IUPAC name chemrof:IUPAC_name Disodium 2,2'-([1,1'-biphenyl]-4,4'-diyldivinylene)bis(benzenesulphonate)
Molecular formula chemrof:molecular_formula C28H20Na2O6S2, C28H22Na2O6S2
SMILES string chemrof:smiles_string O=S(=O)([O-])c1ccccc1C=Cc1ccc(-c2ccc(C=Cc3ccccc3S(=O)(=O)[O-])cc2)cc1.[Na+].[Na+]

Known URLs

2

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=27344-41-8 enrich_references.consensus_cas_link
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/53446122 enrich_references.pubchem_compound

Elementary flows

13
Flow Context Source Unit CFs
79a87d6c-3c6f-4a5d-a34f-626f847c4b20 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
26b13908-cc5b-4491-bb9f-733aa67604d9 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
c661aed3-68bb-4d27-9ddb-32c90eaf17e7 Environmental → Air → Indoor EF 3.1 kg 4
50d4d7d1-650b-40f8-bd42-939b16632552 Environmental → Air → Long-term EF 3.1 kg 0
3d159026-0afc-4658-b30a-cf12e6e81705 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
0f74f41e-ab25-4dc6-8082-55bc8366a4cd Environmental → Air → Unknown EF 3.1 kg 4
564291e1-be6a-44ab-9800-ee993747d51c Environmental → Ground → Agricultural EF 3.1 kg 4
e9841cd2-2b0b-4767-a01c-c2e2019a8291 Environmental → Ground → Non-agricultural EF 3.1 kg 4
a9b9e930-8bf5-4b4f-919c-3f59e5c0386b Environmental → Ground → Unknown EF 3.1 kg 4
5ea5dcec-9f5d-4e6f-aaba-37517df0d18e Environmental → Water → Long-term EF 3.1 kg 0
37024349-9279-4e33-8b9e-b52014f455dd Environmental → Water → Ocean EF 3.1 kg 4
fe2fad2d-8696-484f-a4c6-38c969ac20f3 Environmental → Water → Surface water EF 3.1 kg 4
fc1b8b06-a827-423e-a958-3885721ba965 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON
{
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  "altLabel": [
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    },
    {
      "@value": "Disodium 4′,4′′-bi[stilbene-2,2′′′-disulfonate]",
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      "@value": "Keyfluor CBS-X",
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      "@value": "Keyfluor White CBS-X",
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      "@value": "OB-M 1",
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      "@value": "Optical Brightener CBS-X",
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      "@value": "Stilbene 3",
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      "@value": "Stilbene S-420",
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  ],
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C28H20Na2O6S2",
        "C28H22Na2O6S2"
      ],
      "attested_by": {
        "C28H22Na2O6S2": [
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        ],
        "C28H20Na2O6S2": [
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      "rdfs:label": "Molecular formula",
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