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2-Anthracenesulfonic acid, 4,4'-[1,2-ethanediylbis[imino(6-fluoro-1,3,5-triazine-4,2-diyl)imino(2,4,6-trimethyl-5-sulfo-3,1-phenylene)imino]]bis[1-amino-9,10-dihydro-9,10-dioxo-, sodium salt (1:?)

UUID ed3f5953-8de5-4550-938c-8cd864dfc040
Flow Object IDfo-ee76e584dc8e73fd
Source EF 3.1
Context Environmental → Air → High stack, >150 meters
CAS Numbers 143683-23-2
EC Numbers 411-240-4
prefLabel
Language Value Provenance
en 2-Anthracenesulfonic acid, 4,4'-[1,2-ethanediylbis[imino(6-fluoro-1,3,5-triazine-4,2-diyl)imino(2,4,6-trimethyl-5-sulfo-3,1-phenylene)imino]]bis[1-amino-9,10-dihydro-9,10-dioxo-, sodium salt (1:?)
altLabel ⓘ
Language Value Provenance
en 2-Anthracenesulfonic acid, 4,4′-[1,2-ethanediylbis[imino(6-fluoro-1,3,5-triazine-4,2-diyl)imino(2,4,6-trimethyl-5-sulfo-3,1-phenylene)imino]]bis[1-amino-9,10-dihydro-9,10-dioxo-, sodium salt
en 2-Anthracenesulfonic acid, 4,4′-[1,2-ethanediylbis[imino(6-fluoro-1,3,5-triazine-4,2-diyl)imino(2,4,6-trimethyl-5-sulfo-3,1-phenylene)imino]]bis[1-amino-9,10-dihydro-9,10-dioxo-, sodium salt (1:?)
en Tetrasodium-1,2-bis(4-fluoro-6-[5-(1-amino-2-sulfonatoanthrachinon-4-ylamino)-2,4,6-trimethyl-3-sulfonatophenylamino]-1,3,5-triazin-2-ylamino)ethane
References
Shared Properties
Predicate Value
InChIKey KWLBOZNSJDUHSW-UHFFFAOYSA-J
InChI InChI=1S/C54H46F2N14O16S4.4Na/c1-19-39(61-29-17-31(87(75,76)77)37(57)35-33(29)43(71)25-11-7-9-13-27(25)45(35)73)21(3)47(89(81,82)83)23(5)41(19)63-53-67-49(55)65-51(69-53)59-15-16-60-52-66-50(56)68-54(70-52)64-42-20(2)40(22(4)48(24(42)6)90(84,85)86)62-30-18-32(88(78,79)80)38(58)36-34(30)44(72)26-12-8-10-14-28(26)46(36)74;;;;/h7-14,17-18,61-62H,15-16,57-58H2,1-6H3,(H,75,76,77)(H,78,79,80)(H,81,82,83)(H,84,85,86)(H2,59,63,65,67,69)(H2,60,64,66,68,70);;;;/q;4*+1/p-4
IUPAC name tetrasodium;1-amino-4-[3-[[4-[2-[[4-[3-[(4-amino-9,10-diketo-3-sulfonato-1-anthryl)amino]-2,4,6-trimethyl-5-sulfonato-anilino]-6-fluoro-s-triazin-2-yl]amino]ethylamino]-6-fluoro-s-triazin-2-yl]amino]-2,4,6-trimethyl-5-sulfonato-anilino]-9,10-diketo-anthracene-2-sulfonate, tetrasodium;1-amino-4-[3-[[4-[2-[[4-[3-[(4-amino-9,10-dioxo-3-sulfonato-1-anthracenyl)amino]-2,4,6-trimethyl-5-sulfonatoanilino]-6-fluoro-1,3,5-triazin-2-yl]amino]ethylamino]-6-fluoro-1,3,5-triazin-2-yl]amino]-2,4,6-trimethyl-5-sulfonatoanilino]-9,10-dioxo-2-anthracenesulfonate, tetrasodium;1-amino-4-[3-[[4-[2-[[4-[3-[(4-amino-9,10-dioxo-3-sulfonato-1-anthryl)amino]-2,4,6-trimethyl-5-sulfonato-anilino]-6-fluoro-1,3,5-triazin-2-yl]amino]ethylamino]-6-fluoro-1,3,5-triazin-2-yl]amino]-2,4,6-trimethyl-5-sulfonato-anilino]-9,10-dioxo-anthracene-2-sulfonate, tetrasodium;1-amino-4-[3-[[4-[2-[[4-[3-[(4-amino-9,10-dioxo-3-sulfonatoanthracen-1-yl)amino]-2,4,6-trimethyl-5-sulfonatoanilino]-6-fluoro-1,3,5-triazin-2-yl]amino]ethylamino]-6-fluoro-1,3,5-triazin-2-yl]amino]-2,4,6-trimethyl-5-sulfonatoanilino]-9,10-dioxoanthracene-2-sulfonate, tetrasodium;1-azanyl-4-[[3-[[4-[2-[[4-[[3-[[4-azanyl-9,10-bis(oxidanylidene)-3-sulfonato-anthracen-1-yl]amino]-2,4,6-trimethyl-5-sulfonato-phenyl]amino]-6-fluoranyl-1,3,5-triazin-2-yl]amino]ethylamino]-6-fluoranyl-1,3,5-triazin-2-yl]amino]-2,4,6-trimethyl-5-sulfonato-phenyl]amino]-9,10-bis(oxidanylidene)anthracene-2-sulfonate
Molecular formula C54H42F2N14Na4O16S4
SMILES CC1=C(C(=C(C(=C1NC2=NC(=NC(=N2)NCCNC3=NC(=NC(=N3)F)NC4=C(C(=C(C(=C4C)NC5=CC(=C(C6=C5C(=O)C7=CC=CC=C7C6=O)N)S(=O)(=O)[O-])C)S(=O)(=O)[O-])C)F)C)S(=O)(=O)[O-])C)NC8=CC(=C(C9=C8C(=O)C1=CC=CC=C1C9=O)N)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 ed3f5953-8de5-4550-938c-8cd864dfc040 tetrasodium-1,2-bis(4-fluoro-6-[5-(1-amino-2-sulfonatoanthrachinon-4-ylamino)-2,4,6-trimethyl-3-sulfonatophenylamino]-1,3,5-triazin-2-ylamino)ethane

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 tetrasodium-1,2-bis(4-fluoro-6-[5-(1-amino-2-sulfonatoanthrachinon-4-ylamino)-2,4,6-trimethyl-3-sulfonatophenylamino]-1,3,5-triazin-2-ylamino)ethane Emissions/Emissions to air/Emissions to non-urban air or from high stacks kg exactMatch —

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=tetrasodium-1,2-bis(4-fluoro-6-[5-(1-amino-2-sulfonatoanthrachinon-4-ylamino)-2,4,6-trimethyl-3-sulfonatophenylamino]-1,3,5-triazin-2-ylamino)ethane||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=143683-23-2; added Common Chemistry CAS names as altLabel: 2-Anthracenesulfonic acid, 4,4′-[1,2-ethanediylbis[imino(6-fluoro-1,3,5-triazine-4,2-diyl)imino(2,4,6-trimethyl-5-sulfo-3,1-phenylene)imino]]bis[1-amino-9,10-dihydro-9,10-dioxo-, sodium salt, 2-Anthracenesulfonic acid, 4,4′-[1,2-ethanediylbis[imino(6-fluoro-1,3,5-triazine-4,2-diyl)imino(2,4,6-trimethyl-5-sulfo-3,1-phenylene)imino]]bis[1-amino-9,10-dihydro-9,10-dioxo-, sodium salt (1:?); object_uuid=fo-ee76e584dc8e73fd
cas_match_labels 1 — consensus_match group_key=tetrasodium-1,2-bis(4-fluoro-6-[5-(1-amino-2-sulfonatoanthrachinon-4-ylamino)-2,4,6-trimethyl-3-sulfonatophenylamino]-1,3,5-triazin-2-ylamino)ethane||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=[]; cas_sources={'143683-23-2': []}; assigned CAS labels from group consensus; object_uuid=fo-ee76e584dc8e73fd: {'143683-23-2': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaAir
strataHigh stack, >150 meters

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '2-Anthracenesulfonic acid, 4,4′-[1,2-ethanediylbis[imino(6-fluoro-1,3,5-triazine-4,2-diyl)imino(2,4,6-trimethyl-5-sulfo-3,1-phenylene)imino]]bis[1-amino-9,10-dihydro-9,10-dioxo-, sodium salt', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:143683-23-2', 'https://commonchemistry.cas.org/detail?cas_rn=143683-23-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Anthracenesulfonic acid, 4,4′-[1,2-ethanediylbis[imino(6-fluoro-1,3,5-triazine-4,2-diyl)imino(2,4,6-trimethyl-5-sulfo-3,1-phenylene)imino]]bis[1-amino-9,10-dihydro-9,10-dioxo-, sodium salt (1:?)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:143683-23-2', 'https://commonchemistry.cas.org/detail?cas_rn=143683-23-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=tetrasodium-1,2-bis(4-fluoro-6-[5-(1-amino-2-sulfonatoanthrachinon-4-ylamino)-2,4,6-trimethyl-3-sulfonatophenylamino]-1,3,5-triazin-2-ylamino)ethane||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=143683-23-2; added Common Chemistry CAS names as altLabel: 2-Anthracenesulfonic acid, 4,4′-[1,2-ethanediylbis[imino(6-fluoro-1,3,5-triazine-4,2-diyl)imino(2,4,6-trimethyl-5-sulfo-3,1-phenylene)imino]]bis[1-amino-9,10-dihydro-9,10-dioxo-, sodium salt, 2-Anthracenesulfonic acid, 4,4′-[1,2-ethanediylbis[imino(6-fluoro-1,3,5-triazine-4,2-diyl)imino(2,4,6-trimethyl-5-sulfo-3,1-phenylene)imino]]bis[1-amino-9,10-dihydro-9,10-dioxo-, sodium salt (1:?); object_uuid=fo-ee76e584dc8e73fd
cas_match_labels None {'143683-23-2': 'exactMatch'} group_key=tetrasodium-1,2-bis(4-fluoro-6-[5-(1-amino-2-sulfonatoanthrachinon-4-ylamino)-2,4,6-trimethyl-3-sulfonatophenylamino]-1,3,5-triazin-2-ylamino)ethane||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=[]; cas_sources={'143683-23-2': []}; assigned CAS labels from group consensus; object_uuid=fo-ee76e584dc8e73fd: {'143683-23-2': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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  },
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    {
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      "methodology": "Environmental Footprint",
      "impact_category": "Non-cancer human health effects",
      "impact_indicator": "Comparative Toxic Unit for human (CTUh)",
      "characterization_factor": 2.5074e-6
    },
    {
      "method_uuid": "8c3141e9-1f15-43b5-bff2-182e49893a46",
      "name": "Human toxicity, non-cancer_organics",
      "methodology": "Environmental Footprint",
      "impact_category": "Non-cancer human health effects",
      "impact_indicator": "Comparative Toxic Unit for human (CTUh)",
      "characterization_factor": 2.5074e-6
    },
    {
      "method_uuid": "fd530f00-9325-424a-92ef-aaac67922fd9",
      "name": "Ecotoxicity, freshwater_organics",
      "methodology": "Environmental Footprint",
      "impact_category": "Aquatic eco-toxicity",
      "impact_indicator": "Comparative Toxic Unit for ecosystems (CTUe) ",
      "characterization_factor": 0.0026988
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  ],
  "source": "EF 3.1",
  "identifier": "ed3f5953-8de5-4550-938c-8cd864dfc040",
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        "tetrasodium;1-amino-4-[3-[[4-[2-[[4-[3-[(4-amino-9,10-dioxo-3-sulfonato-1-anthracenyl)amino]-2,4,6-trimethyl-5-sulfonatoanilino]-6-fluoro-1,3,5-triazin-2-yl]amino]ethylamino]-6-fluoro-1,3,5-triazin-2-yl]amino]-2,4,6-trimethyl-5-sulfonatoanilino]-9,10-dioxo-2-anthracenesulfonate",
        "tetrasodium;1-amino-4-[3-[[4-[2-[[4-[3-[(4-amino-9,10-dioxo-3-sulfonato-1-anthryl)amino]-2,4,6-trimethyl-5-sulfonato-anilino]-6-fluoro-1,3,5-triazin-2-yl]amino]ethylamino]-6-fluoro-1,3,5-triazin-2-yl]amino]-2,4,6-trimethyl-5-sulfonato-anilino]-9,10-dioxo-anthracene-2-sulfonate",
        "tetrasodium;1-amino-4-[3-[[4-[2-[[4-[3-[(4-amino-9,10-dioxo-3-sulfonatoanthracen-1-yl)amino]-2,4,6-trimethyl-5-sulfonatoanilino]-6-fluoro-1,3,5-triazin-2-yl]amino]ethylamino]-6-fluoro-1,3,5-triazin-2-yl]amino]-2,4,6-trimethyl-5-sulfonatoanilino]-9,10-dioxoanthracene-2-sulfonate",
        "tetrasodium;1-azanyl-4-[[3-[[4-[2-[[4-[[3-[[4-azanyl-9,10-bis(oxidanylidene)-3-sulfonato-anthracen-1-yl]amino]-2,4,6-trimethyl-5-sulfonato-phenyl]amino]-6-fluoranyl-1,3,5-triazin-2-yl]amino]ethylamino]-6-fluoranyl-1,3,5-triazin-2-yl]amino]-2,4,6-trimethyl-5-sulfonato-phenyl]amino]-9,10-bis(oxidanylidene)anthracene-2-sulfonate"
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      "@value": "2-Anthracenesulfonic acid, 4,4′-[1,2-ethanediylbis[imino(6-fluoro-1,3,5-triazine-4,2-diyl)imino(2,4,6-trimethyl-5-sulfo-3,1-phenylene)imino]]bis[1-amino-9,10-dihydro-9,10-dioxo-, sodium salt",
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      "@value": "2-Anthracenesulfonic acid, 4,4′-[1,2-ethanediylbis[imino(6-fluoro-1,3,5-triazine-4,2-diyl)imino(2,4,6-trimethyl-5-sulfo-3,1-phenylene)imino]]bis[1-amino-9,10-dihydro-9,10-dioxo-, sodium salt (1:?)",
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