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Sodium 4-hydroxybenzenesulphonate

UUID fd55e47d-0dd7-4027-8eed-b15b2f820eff
Deprecated yes
Replaced By 10d2a808-50e8-4498-8e19-4df375046b4b
Flow Object IDfo-9b33eb7e24e73886
Source EF 3.1
Context Environmental → Ground → Unknown
CAS Numbers 825-90-1
EC Numbers 212-550-0
prefLabel
Language Value Provenance
en Sodium 4-hydroxybenzenesulphonate
altLabel
Language Value Provenance
en 4-Hydroxybenzenesulfonic acid sodium salt
en <em>p</em>-Hydroxybenzenesulfonic acid monosodium salt
en <em>p</em>-Hydroxybenzenesulfonic acid sodium salt
en <em>p</em>-Phenolsulfonic acid sodium salt
en Benzenesulfonic acid, 4-hydroxy-, monosodium salt
en Benzenesulfonic acid, 4-hydroxy-, sodium salt (1:1)
en Benzenesulfonic acid, <em>p</em>-hydroxy-, monosodium salt
en Sodium 4-hydroxybenzenesulfonate
en Sodium <em>p</em>-hydroxybenzenesulfonate
en Sodium <em>p</em>-hydroxyphenylsulfonate
en Sodium <em>p</em>-phenolsulfonate
References
Shared Properties
Predicate Value
InChIKey BYMHXIQVEAYSJD-UHFFFAOYSA-M, BYMHXIQVEAYSJD-UHFFFAOYSA-N, IPWBXNQFVYOABB-UHFFFAOYSA-N, NIQLRARIYNRGCQ-UHFFFAOYSA-N, SXONATFNYJWFNK-UHFFFAOYSA-M, ULUPAWKAWBVCAI-UHFFFAOYSA-N
InChI InChI=1S/C11H16O2/c12-5-10-8-4-9(11(10)13)7-3-1-2-6(7)8/h1,3,6-13H,2,4-5H2, InChI=1S/C14H12ClN3O2/c15-11-5-1-9(2-6-11)13(19)17-12-7-3-10(4-8-12)14(20)18-16/h1-8H,16H2,(H,17,19)(H,18,20), InChI=1S/C6H6O4S.Na.2H2O/c7-5-1-3-6(4-2-5)11(8,9)10;;;/h1-4,7H,(H,8,9,10);;2*1H2/q;+1;;/p-1, InChI=1S/C6H6O4S.Na/c7-5-1-3-6(4-2-5)11(8,9)10;/h1-4,7H,(H,8,9,10);, InChI=1S/C6H6O4S.Na/c7-5-1-3-6(4-2-5)11(8,9)10;/h1-4,7H,(H,8,9,10);/q;+1, InChI=1S/C6H6O4S.Na/c7-5-1-3-6(4-2-5)11(8,9)10;/h1-4,7H,(H,8,9,10);/q;+1/p-1
IUPAC name 4-chloro-N-[4-(hydrazinecarbonyl)phenyl]benzamide, 9-(hydroxymethyl)-8-tricyclo[5.2.1.02,6]dec-4-enol, 9-(hydroxymethyl)tricyclo[5.2.1.02,6]dec-4-en-8-ol, 9-methyloltricyclo[5.2.1.02,6]dec-4-en-8-ol, N-(4-carbazoylphenyl)-4-chloro-benzamide, N-[4-(aminocarbamoyl)phenyl]-4-chloranyl-benzamide, sodium 4-hydroxybenzenesulfonate, sodium 4-hydroxybenzenesulfonic acid, sodium 4-hydroxybesylate, sodium 4-hydroxybesylic acid, sodium 4-oxidanylbenzenesulfonate, sodium 4-oxidanylbenzenesulfonic acid, sodium 4-sulfophenolate, sodium;4-hydroxybenzenesulfonate;dihydrate, sodium;4-hydroxybesylate;dihydrate, sodium;4-oxidanylbenzenesulfonate;dihydrate
Molecular formula C11H16O2, C14H12ClN3O2, C6H5NaO4S, C6H6NaO4S, C6H6NaO4S+, C6H9NaO6S
SMILES C1=CC(=CC=C1C(=O)NN)NC(=O)C2=CC=C(C=C2)Cl, C1=CC(=CC=C1O)S(=O)(=O)O.[Na+], C1=CC(=CC=C1O)S(=O)(=O)O.[Na], C1=CC(=CC=C1O)S(=O)(=O)[O-].O.O.[Na+], C1=CC(=CC=C1O)S(=O)(=O)[O-].[Na+], C1=CC(=CC=C1[O-])S(=O)(=O)O.[Na+], C1C=CC2C1C3CC2C(C3CO)O

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 fd55e47d-0dd7-4027-8eed-b15b2f820eff sodium 4-hydroxybenzenesulphonate

Consolidated Field Provenance

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

Field Change Count Latest Time Transformers Latest Comment
altLabel 1 consensus_match group_key=sodium4-hydroxybenzenesulphonate||dimension=Environmental > media=Water > water_body=Unknown; cas=825-90-1; added Common Chemistry CAS names as altLabel: 4-Hydroxybenzenesulfonic acid sodium salt, <em>p</em>-Hydroxybenzenesulfonic acid monosodium salt, <em>p</em>-Hydroxybenzenesulfonic acid sodium salt, <em>p</em>-Phenolsulfonic acid sodium salt, Benzenesulfonic acid, 4-hydroxy-, monosodium salt, Benzenesulfonic acid, 4-hydroxy-, sodium salt (1:1), Benzenesulfonic acid, <em>p</em>-hydroxy-, monosodium salt, Sodium 4-hydroxybenzenesulfonate, Sodium <em>p</em>-hydroxybenzenesulfonate, Sodium <em>p</em>-hydroxyphenylsulfonate, Sodium <em>p</em>-phenolsulfonate; object_uuid=fo-9b33eb7e24e73886
cas_match_labels 1 consensus_match group_key=sodium4-hydroxybenzenesulphonate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'825-90-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-9b33eb7e24e73886: {'825-90-1': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaGround
geographyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '4-Hydroxybenzenesulfonic acid sodium salt', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:825-90-1', 'https://commonchemistry.cas.org/detail?cas_rn=825-90-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>p</em>-Hydroxybenzenesulfonic acid monosodium salt', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:825-90-1', 'https://commonchemistry.cas.org/detail?cas_rn=825-90-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>p</em>-Hydroxybenzenesulfonic acid sodium salt', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:825-90-1', 'https://commonchemistry.cas.org/detail?cas_rn=825-90-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>p</em>-Phenolsulfonic acid sodium salt', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:825-90-1', 'https://commonchemistry.cas.org/detail?cas_rn=825-90-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzenesulfonic acid, 4-hydroxy-, monosodium salt', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:825-90-1', 'https://commonchemistry.cas.org/detail?cas_rn=825-90-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzenesulfonic acid, 4-hydroxy-, sodium salt (1:1)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:825-90-1', 'https://commonchemistry.cas.org/detail?cas_rn=825-90-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzenesulfonic acid, <em>p</em>-hydroxy-, monosodium salt', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:825-90-1', 'https://commonchemistry.cas.org/detail?cas_rn=825-90-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Sodium 4-hydroxybenzenesulfonate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:825-90-1', 'https://commonchemistry.cas.org/detail?cas_rn=825-90-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Sodium <em>p</em>-hydroxybenzenesulfonate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:825-90-1', 'https://commonchemistry.cas.org/detail?cas_rn=825-90-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Sodium <em>p</em>-hydroxyphenylsulfonate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:825-90-1', 'https://commonchemistry.cas.org/detail?cas_rn=825-90-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Sodium <em>p</em>-phenolsulfonate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:825-90-1', 'https://commonchemistry.cas.org/detail?cas_rn=825-90-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=sodium4-hydroxybenzenesulphonate||dimension=Environmental > media=Water > water_body=Unknown; cas=825-90-1; added Common Chemistry CAS names as altLabel: 4-Hydroxybenzenesulfonic acid sodium salt, <em>p</em>-Hydroxybenzenesulfonic acid monosodium salt, <em>p</em>-Hydroxybenzenesulfonic acid sodium salt, <em>p</em>-Phenolsulfonic acid sodium salt, Benzenesulfonic acid, 4-hydroxy-, monosodium salt, Benzenesulfonic acid, 4-hydroxy-, sodium salt (1:1), Benzenesulfonic acid, <em>p</em>-hydroxy-, monosodium salt, Sodium 4-hydroxybenzenesulfonate, Sodium <em>p</em>-hydroxybenzenesulfonate, Sodium <em>p</em>-hydroxyphenylsulfonate, Sodium <em>p</em>-phenolsulfonate; object_uuid=fo-9b33eb7e24e73886
cas_match_labels None {'825-90-1': 'exactMatch'} group_key=sodium4-hydroxybenzenesulphonate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'825-90-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-9b33eb7e24e73886: {'825-90-1': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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  "general_comment": "Correct mapping CAS and flow to be verified: yet unclear whether this is the sodium-, hydrochloride-, calcium-, potassium- or other salt or the pure substance that is emitted. Note that the CAS No is the relevant identifier, to which also the ILCD LCIA characterisation factors relate. Reference elementary flow of the International Reference Life Cycle Data System (ILCD).",
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        "9-(hydroxymethyl)tricyclo[5.2.1.02,6]dec-4-en-8-ol",
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        "sodium 4-hydroxybenzenesulfonate",
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