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Benzenesulfonic acid

UUID 0c3cfc10-3896-4e70-87eb-eba4a892b593
Flow Object IDfo-0c4e1bfe75ad05e3
Source EF 3.1
Context Environmental → Ground → Unknown
CAS Numbers 98-11-3
EC Numbers 202-638-7
prefLabel ⓘ
Language Value Provenance
en Benzenesulfonic acid
altLabel ⓘ
Language Value Provenance
en Benzene sulphonic acid
en Benzenemonosulfonic acid
en Besylic acid
en Phenylsulfonic acid
en 17-120A
en 1: PN: WO2020008043 SEQID: 105 claimed sequence
en Alkylbenzenesulfonate
en BSA
en BW 70
en Benzenesulfonic acid (surfactant)
en Benzensulfonic acid
en Nansa 63B
Definitions
Language Value Provenance
en The simplest member of the class of a benzenesulfonic acids that consists of a benzene carrying a single sulfo group.
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey SRSXLGNVWSONIS-UHFFFAOYSA-N
InChI InChI=1S/C6H6O3S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H,7,8,9)
IUPAC name benzenesulfonic acid, besylic acid
Molecular formula C6H6O3S
Molecular mass 158.178
Monoisotopic mass 158.00377
SMILES C1=CC=C(C=C1)S(=O)(=O)O, O=S(=O)(O)c1ccccc1

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 0c3cfc10-3896-4e70-87eb-eba4a892b593 benzenesulphonic acid

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 benzenesulphonic acid Emissions/Emissions to soil/Emissions to non-agricultural soil kg exactMatch —

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field Change Count Latest Time Transformers Latest Comment
altLabel 2 — consensus_match group_key=benzenesulphonicacid||dimension=Environmental > media=Water > water_body=Surface water; cas=98-11-3; added Common Chemistry CAS names as altLabel: 17-120A, 1: PN: WO2020008043 SEQID: 105 claimed sequence, Alkylbenzenesulfonate, BSA, BW 70, Benzenesulfonic acid (surfactant), Benzensulfonic acid, Nansa 63B; object_uuid=fo-0c4e1bfe75ad05e3
cas_match_labels 1 — consensus_match group_key=benzenesulphonicacid||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'98-11-3': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-0c4e1bfe75ad05e3: {'98-11-3': 'exactMatch'}
prefLabel 1 — consensus_match cas=98-11-3; cc_chebi_agreed_name='Benzenesulfonic acid'; object_uuid=fo-0c4e1bfe75ad05e3

Context Attributes

AttributeValue
dimensionEnvironmental
mediaGround
geographyUnknown

Consensus Changes

Field Old Value New Value Comment
prefLabel [{'@value': 'Benzenesulphonic Acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'bootstrap_labels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'legacy name field'}}] [{'@value': 'Benzenesulfonic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:98-11-3'], 'prov:wasDerivedFrom': 'Common Chemistry / ChEBI primary name agreement'}}] cas=98-11-3; cc_chebi_agreed_name='Benzenesulfonic acid'; object_uuid=fo-0c4e1bfe75ad05e3
altLabel [{'@value': 'Benzene sulphonic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Benzene sulphonic acid', 'http://purl.obolibrary.org/obo/CHEBI_64455', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Benzenemonosulfonic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Benzenemonosulfonic acid', 'http://purl.obolibrary.org/obo/CHEBI_64455', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Besylic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Besylic acid', 'http://purl.obolibrary.org/obo/CHEBI_64455', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Phenylsulfonic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Phenylsulfonic acid', 'http://purl.obolibrary.org/obo/CHEBI_64455', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': 'Benzene sulphonic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Benzene sulphonic acid', 'http://purl.obolibrary.org/obo/CHEBI_64455', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Benzenemonosulfonic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Benzenemonosulfonic acid', 'http://purl.obolibrary.org/obo/CHEBI_64455', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Besylic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Besylic acid', 'http://purl.obolibrary.org/obo/CHEBI_64455', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Phenylsulfonic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Phenylsulfonic acid', 'http://purl.obolibrary.org/obo/CHEBI_64455', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Benzenesulphonic Acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original name retained as altLabel'}}] cas=98-11-3; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-0c4e1bfe75ad05e3
altLabel [{'@value': 'Benzene sulphonic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Benzene sulphonic acid', 'http://purl.obolibrary.org/obo/CHEBI_64455', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Benzenemonosulfonic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Benzenemonosulfonic acid', 'http://purl.obolibrary.org/obo/CHEBI_64455', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Besylic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Besylic acid', 'http://purl.obolibrary.org/obo/CHEBI_64455', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Phenylsulfonic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Phenylsulfonic acid', 'http://purl.obolibrary.org/obo/CHEBI_64455', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Benzenesulphonic Acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original name retained as altLabel'}}] [{'@value': 'Benzene sulphonic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Benzene sulphonic acid', 'http://purl.obolibrary.org/obo/CHEBI_64455', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Benzenemonosulfonic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Benzenemonosulfonic acid', 'http://purl.obolibrary.org/obo/CHEBI_64455', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Besylic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Besylic acid', 'http://purl.obolibrary.org/obo/CHEBI_64455', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Phenylsulfonic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Phenylsulfonic acid', 'http://purl.obolibrary.org/obo/CHEBI_64455', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '17-120A', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:98-11-3', 'https://commonchemistry.cas.org/detail?cas_rn=98-11-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1: PN: WO2020008043 SEQID: 105 claimed sequence', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:98-11-3', 'https://commonchemistry.cas.org/detail?cas_rn=98-11-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Alkylbenzenesulfonate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:98-11-3', 'https://commonchemistry.cas.org/detail?cas_rn=98-11-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'BSA', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:98-11-3', 'https://commonchemistry.cas.org/detail?cas_rn=98-11-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'BW 70', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:98-11-3', 'https://commonchemistry.cas.org/detail?cas_rn=98-11-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzenesulfonic acid (surfactant)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:98-11-3', 'https://commonchemistry.cas.org/detail?cas_rn=98-11-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzensulfonic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:98-11-3', 'https://commonchemistry.cas.org/detail?cas_rn=98-11-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Nansa 63B', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:98-11-3', 'https://commonchemistry.cas.org/detail?cas_rn=98-11-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=benzenesulphonicacid||dimension=Environmental > media=Water > water_body=Surface water; cas=98-11-3; added Common Chemistry CAS names as altLabel: 17-120A, 1: PN: WO2020008043 SEQID: 105 claimed sequence, Alkylbenzenesulfonate, BSA, BW 70, Benzenesulfonic acid (surfactant), Benzensulfonic acid, Nansa 63B; object_uuid=fo-0c4e1bfe75ad05e3
cas_match_labels None {'98-11-3': 'exactMatch'} group_key=benzenesulphonicacid||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'98-11-3': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-0c4e1bfe75ad05e3: {'98-11-3': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

{
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  "name": null,
  "cas_numbers": [
    "98-11-3"
  ],
  "ec_numbers": [
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  "context": {
    "dimension": "Environmental",
    "media": "Ground",
    "geography": "Unknown"
  },
  "general_comment": null,
  "synonyms": [],
  "unit": "kg",
  "lcia_methods": [
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      "name": "Ecotoxicity, freshwater",
      "methodology": "Environmental Footprint",
      "impact_category": "Aquatic eco-toxicity",
      "impact_indicator": "Comparative Toxic Unit for ecosystems (CTUe) ",
      "characterization_factor": 15.009
    },
    {
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      "name": "Human toxicity, non-cancer",
      "methodology": "Environmental Footprint",
      "impact_category": "Non-cancer human health effects",
      "impact_indicator": "Comparative Toxic Unit for human (CTUh)",
      "characterization_factor": 8.0349e-9
    },
    {
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      "name": "Human toxicity, non-cancer_organics",
      "methodology": "Environmental Footprint",
      "impact_category": "Non-cancer human health effects",
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      "characterization_factor": 8.0349e-9
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      "impact_indicator": "Comparative Toxic Unit for ecosystems (CTUe) ",
      "characterization_factor": 15.009
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  ],
  "source": "EF 3.1",
  "identifier": "0c3cfc10-3896-4e70-87eb-eba4a892b593",
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      "source_metadata": {
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        "original_context": [
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          "Emissions to soil",
          "Emissions to non-agricultural soil"
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    }
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