Consensus flow list

4,4'-oxydibenzenesulfonohydrazide

fo-4d0559bca89a3b2f

Identity

Type
NeutralMolecule
CAS
80-51-3
EC
201-286-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 4,4'-oxydibenzenesulfonohydrazide

Alternative labels

61

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string NBOCQTNZUPTTEI-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C12H14N4O5S2/c13-15-22(17,18)11-5-1-9(2-6-11)21-10-3-7-12(8-4-10)23(19,20)16-14/h1-8,15-16H,13-14H2
IUPAC name chemrof:IUPAC_name 4,4'-oxydibenzenesulfonohydrazide
Molecular formula chemrof:molecular_formula C12H14N4O5S2
Molecular mass chemrof:molecular_mass 358.401
Monoisotopic mass chemrof:monoisotopic_mass 358.040562
SMILES string chemrof:smiles_string NNS(=O)(=O)c1ccc(Oc2ccc(S(=O)(=O)NN)cc2)cc1

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=80-51-3 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.001.170 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID7026499 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=5318 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1882501 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/70377EJ95Z enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J60.166G enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/6649 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27265828 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
eaca6ec1-6794-4ced-858a-1ebf5ca48f3e Environmental → Air → Aircraft cruise height EF 3.1 kg 4
701a9f41-c159-47ca-b56f-9ca262e0df88 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
75d8a567-f308-4740-987f-89d15606f276 Environmental → Air → Indoor EF 3.1 kg 4
9d4f7bbe-15d1-49b8-8cc7-fab6022b6b85 Environmental → Air → Long-term EF 3.1 kg 0
723055ec-8d1f-4f10-bc8a-b91239527673 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
00148a25-490c-4cbb-8958-3aa8043fb7b3 Environmental → Air → Unknown EF 3.1 kg 4
49fcc039-560b-4aa1-b9f4-b3bd0557d7b6 Environmental → Ground → Agricultural EF 3.1 kg 4
508a5e8d-ff7c-4810-affd-bfe0f1e72111 Environmental → Ground → Non-agricultural EF 3.1 kg 4
9da24e9e-1fe2-422d-b43c-546c7afd46d4 Environmental → Ground → Unknown EF 3.1 kg 4
a7cf0dde-577d-4c53-9689-e2e0a630726e Environmental → Water → Long-term EF 3.1 kg 0
fa4c1dd1-44dd-411f-8b84-d7c6ab990637 Environmental → Water → Ocean EF 3.1 kg 4
20102e91-29a4-4638-9c65-58e125e3148f Environmental → Water → Surface water EF 3.1 kg 4
701b0355-210f-4894-85d0-e5cb0e89aa37 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-4d0559bca89a3b2f",
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  "classifications": {
    "http://semanticscience.org/resource/CHEMINF_000446": {
      "@value": [
        "80-51-3"
      ],
      "rdfs:seeAlso": [
        "https://commonchemistry.cas.org/detail?cas_rn=80-51-3"
      ],
      "http://www.w3.org/2004/02/skos/core#exactMatch": [
        {
          "@id": "https://commonchemistry.cas.org/detail?cas_rn=80-51-3"
        }
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    "http://semanticscience.org/resource/CHEMINF_000447": {
      "@value": [
        "201-286-1"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=201-286-1"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "ec_numbers"
      }
    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ]
}

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