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Sodium 4-(6-ethyldecyl)benzenesulfonate

Flow Object IDfo-b02b20b8033a3716
TypeConsensus
prefLabel
Label Language
Sodium 4-(6-ethyldecyl)benzenesulfonate en
Alt Labels
Label Language Provenance
Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts en —
CAS Numbers68608-89-9
EC Numbers271-808-0
Changes Applied26

Properties

Predicate Value
InChIKey HLZPFMSGWIVXAK-UHFFFAOYSA-M
InChI InChI=1S/C18H30O3S.Na/c1-3-5-9-16(4-2)10-7-6-8-11-17-12-14-18(15-13-17)22(19,20)21;/h12-16H,3-11H2,1-2H3,(H,19,20,21);/q;+1/p-1
IUPAC name sodium 4-(6-ethyldecyl)benzenesulfonate, sodium 4-(6-ethyldecyl)besylate
Molecular formula C18H29NaO3S
SMILES CCCCC(CC)CCCCCC1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]

References

Linked Elementary Flows

UUID Source Unit Context LCIA Factors Consensus Changes
a2dd5967… EF 3.1 kg Environmental → Air → Aircraft cruise height 2 2
ca5c77a1… EF 3.1 kg Environmental → Air → Ground level → Rural (<1000 people/square mile) 0 2
0699978c… EF 3.1 kg Environmental → Air → Ground level → Urban (>1000 people/square mile) 2 2
9c3ddde0… EF 3.1 kg Environmental → Air → High stack, >150 meters 2 2
0987a94e… EF 3.1 kg Environmental → Air → Unknown 2 2
cc4de730… EF 3.1 kg Environmental → Air → Unknown 2 2
06a9087e… EF 3.1 kg Environmental → Ground → Agricultural 2 2
649c9b5a… EF 3.1 kg Environmental → Ground → Unknown 2 2
d7260d25… EF 3.1 kg Environmental → Water → Ocean 2 2
709758cb… EF 3.1 kg Environmental → Water → Surface water 2 2
d8db5805… EF 3.1 kg Environmental → Water → Unknown 2 2
▶

Changes Applied
Elementary Flow Field Old Value New Value Comment
0699978c… altLabel — [{"@value":"Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68608-89-9","https://commonchemistry.cas.org/detail?cas_rn=68608-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=68608-89-9; added Common Chemistry CAS names as altLabel: Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts; object_uuid=fo-b02b20b8033a3716
0699978c… cas_match_labels — {"68608-89-9":"exactMatch"} group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'68608-89-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b02b20b8033a3716: {'68608-89-9': 'exactMatch'}
06a9087e… altLabel — [{"@value":"Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68608-89-9","https://commonchemistry.cas.org/detail?cas_rn=68608-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=68608-89-9; added Common Chemistry CAS names as altLabel: Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts; object_uuid=fo-b02b20b8033a3716
06a9087e… cas_match_labels — {"68608-89-9":"exactMatch"} group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'68608-89-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b02b20b8033a3716: {'68608-89-9': 'exactMatch'}
0987a94e… altLabel — [{"@value":"Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68608-89-9","https://commonchemistry.cas.org/detail?cas_rn=68608-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=68608-89-9; added Common Chemistry CAS names as altLabel: Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts; object_uuid=fo-b02b20b8033a3716
0987a94e… cas_match_labels — {"68608-89-9":"exactMatch"} group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'68608-89-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b02b20b8033a3716: {'68608-89-9': 'exactMatch'}
2fb2f315… altLabel — [{"@value":"Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68608-89-9","https://commonchemistry.cas.org/detail?cas_rn=68608-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=68608-89-9; added Common Chemistry CAS names as altLabel: Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts; object_uuid=fo-b02b20b8033a3716
2fb2f315… cas_match_labels — {"68608-89-9":"exactMatch"} group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'68608-89-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b02b20b8033a3716: {'68608-89-9': 'exactMatch'}
649c9b5a… altLabel — [{"@value":"Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68608-89-9","https://commonchemistry.cas.org/detail?cas_rn=68608-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=68608-89-9; added Common Chemistry CAS names as altLabel: Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts; object_uuid=fo-b02b20b8033a3716
649c9b5a… cas_match_labels — {"68608-89-9":"exactMatch"} group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'68608-89-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b02b20b8033a3716: {'68608-89-9': 'exactMatch'}
709758cb… altLabel — [{"@value":"Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68608-89-9","https://commonchemistry.cas.org/detail?cas_rn=68608-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=68608-89-9; added Common Chemistry CAS names as altLabel: Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts; object_uuid=fo-b02b20b8033a3716
709758cb… cas_match_labels — {"68608-89-9":"exactMatch"} group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'68608-89-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b02b20b8033a3716: {'68608-89-9': 'exactMatch'}
8ae342bb… altLabel — [{"@value":"Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68608-89-9","https://commonchemistry.cas.org/detail?cas_rn=68608-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=68608-89-9; added Common Chemistry CAS names as altLabel: Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts; object_uuid=fo-b02b20b8033a3716
8ae342bb… cas_match_labels — {"68608-89-9":"exactMatch"} group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'68608-89-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b02b20b8033a3716: {'68608-89-9': 'exactMatch'}
9c3ddde0… altLabel — [{"@value":"Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68608-89-9","https://commonchemistry.cas.org/detail?cas_rn=68608-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=68608-89-9; added Common Chemistry CAS names as altLabel: Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts; object_uuid=fo-b02b20b8033a3716
9c3ddde0… cas_match_labels — {"68608-89-9":"exactMatch"} group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'68608-89-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b02b20b8033a3716: {'68608-89-9': 'exactMatch'}
a2dd5967… altLabel — [{"@value":"Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68608-89-9","https://commonchemistry.cas.org/detail?cas_rn=68608-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=68608-89-9; added Common Chemistry CAS names as altLabel: Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts; object_uuid=fo-b02b20b8033a3716
a2dd5967… cas_match_labels — {"68608-89-9":"exactMatch"} group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'68608-89-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b02b20b8033a3716: {'68608-89-9': 'exactMatch'}
ca5c77a1… altLabel — [{"@value":"Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68608-89-9","https://commonchemistry.cas.org/detail?cas_rn=68608-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=68608-89-9; added Common Chemistry CAS names as altLabel: Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts; object_uuid=fo-b02b20b8033a3716
ca5c77a1… cas_match_labels — {"68608-89-9":"exactMatch"} group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'68608-89-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b02b20b8033a3716: {'68608-89-9': 'exactMatch'}
cc4de730… altLabel — [{"@value":"Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68608-89-9","https://commonchemistry.cas.org/detail?cas_rn=68608-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=68608-89-9; added Common Chemistry CAS names as altLabel: Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts; object_uuid=fo-b02b20b8033a3716
cc4de730… cas_match_labels — {"68608-89-9":"exactMatch"} group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'68608-89-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b02b20b8033a3716: {'68608-89-9': 'exactMatch'}
d7260d25… altLabel — [{"@value":"Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68608-89-9","https://commonchemistry.cas.org/detail?cas_rn=68608-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=68608-89-9; added Common Chemistry CAS names as altLabel: Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts; object_uuid=fo-b02b20b8033a3716
d7260d25… cas_match_labels — {"68608-89-9":"exactMatch"} group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'68608-89-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b02b20b8033a3716: {'68608-89-9': 'exactMatch'}
d8db5805… altLabel — [{"@value":"Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68608-89-9","https://commonchemistry.cas.org/detail?cas_rn=68608-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=68608-89-9; added Common Chemistry CAS names as altLabel: Benzenesulfonic acid, mono-C<sub>11-13</sub>-branched alkyl derivs., sodium salts; object_uuid=fo-b02b20b8033a3716
d8db5805… cas_match_labels — {"68608-89-9":"exactMatch"} group_key=sodium4-(6-ethyldecyl)benzenesulfonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'68608-89-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b02b20b8033a3716: {'68608-89-9': 'exactMatch'}

Flow Object JSON

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  "prefLabel": [
    {
      "@value": "Sodium 4-(6-ethyldecyl)benzenesulfonate",
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      "@lang": "en",
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  "altLabel": [
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  "properties": {
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      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C18H29NaO3S"
      ],
      "rdfs:label": "Molecular formula",
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    "https://w3id.org/chemrof/inchi2d_key_string": {
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    "https://w3id.org/chemrof/smiles_string": {
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        "CCCCC(CC)CCCCCC1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]"
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      "rdfs:label": "SMILES",
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    "https://w3id.org/chemrof/inchi2d_string": {
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    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "@value": [
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  "created_from": {
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    "seed_uuid": "0699978c-290d-4a8f-80c7-fdc895a18575",
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  "classifications": {
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  "origin_qualifier": null,
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}