Sodium 4-hydroxy-3,5-diiodophenylcyanide
73aa0ae5-013f-49c6-9939-72550f65307c
Identity
- Substance
- fo-caaf33d7b208785d Molecular complex
- Source
- EF 3.1
- Unit
- kg
- Context
- Environmental → Water → Ocean
- CAS
- 2961-62-8
- EC
- 220-995-7
Context
- Dimension
- Environmental
- Media
- Water
- Water body
- Ocean
Alternative labels
6- 2,6-Diiodo-4-cyanophenol sodium salt
- 3,5-Diiodo-4-hydroxybenzonitrile sodium salt
- Benzonitrile, 4-hydroxy-3,5-diiodo-, sodium salt
- Benzonitrile, 4-hydroxy-3,5-diiodo-, sodium salt (1:1)
- Ioxynil sodium
- Sodium, (4-cyano-2,6-diiodophenoxy)-
Source lists
1| List | Version | Source flow | Name there | Why this flow |
|---|---|---|---|---|
| EF | 3.1 | 73aa0ae5-013f-49c6-9939-72550f65307c | sodium 4-hydroxy-3,5-diiodophenylcyanide | The consensus list is built from this one, so this row is the flow itself rather than something matched to it. |
Concept associations
1| Source list | Source flow | Name there | Compartment there | Match | Conversion |
|---|---|---|---|---|---|
| EF 3.1 | 73aa0ae5-013f-49c6-9939-72550f65307c | sodium 4-hydroxy-3,5-diiodophenylcyanide | Emissions/Emissions to water/Emissions to sea water | exactMatch | — |
Characterisation factors
4- consensus-flow-list 2
- European Commission — JRC 2
Every implementation that says anything about this flow. Published as is what this list did with the row: where more than one implementation states a number and they agree it publishes it as agreed; where only one speaks, as sole; where they disagree it publishes nothing and asks.
| Method | Implementation | Category | Place | Factor | Published as |
|---|---|---|---|---|---|
| EF 3.1 | European Commission — JRC | Ecotoxicity, freshwater | — | 6.4145e-13 | — |
| EF 3.1 | consensus-flow-list | Ecotoxicity, freshwater | — | 6.4145e-13 | sole |
| EF 3.1 | European Commission — JRC | Ecotoxicity, freshwater_organics | — | 6.4145e-13 | — |
| EF 3.1 | consensus-flow-list | Ecotoxicity, freshwater_organics | — | 6.4145e-13 | sole |
History
The change log and the PROV-O trail (2 consensus changes)
These are the heaviest sections of this page and the least often read, so the page does not pay for them until you ask.
Full record
Flow JSON
{
"altLabel": [
{
"@value": "2,6-Diiodo-4-cyanophenol sodium salt",
"@language": "en",
"source": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2961-62-8",
"https://commonchemistry.cas.org/detail?cas_rn=2961-62-8"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "3,5-Diiodo-4-hydroxybenzonitrile sodium salt",
"@language": "en",
"source": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2961-62-8",
"https://commonchemistry.cas.org/detail?cas_rn=2961-62-8"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Benzonitrile, 4-hydroxy-3,5-diiodo-, sodium salt",
"@language": "en",
"source": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2961-62-8",
"https://commonchemistry.cas.org/detail?cas_rn=2961-62-8"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Benzonitrile, 4-hydroxy-3,5-diiodo-, sodium salt (1:1)",
"@language": "en",
"source": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2961-62-8",
"https://commonchemistry.cas.org/detail?cas_rn=2961-62-8"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Ioxynil sodium",
"@language": "en",
"source": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2961-62-8",
"https://commonchemistry.cas.org/detail?cas_rn=2961-62-8"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Sodium, (4-cyano-2,6-diiodophenoxy)-",
"@language": "en",
"source": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2961-62-8",
"https://commonchemistry.cas.org/detail?cas_rn=2961-62-8"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
}
],
"properties": {
"https://w3id.org/chemrof/molecular_formula": {
"@id": "https://w3id.org/chemrof/molecular_formula",
"@value": [
"C7H2I2NNaO",
"C7H3I2NNaO"
],
"attested_by": {
"C7H2I2NNaO": [
"enrich_references.pubchem_semantic"
],
"C7H3I2NNaO": [
"rdkit_post_consensus"
]
},
"rdfs:label": "Molecular formula",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:23666695"
],
"prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"N#Cc1cc(I)c(O)c(I)c1.[Na]"
]
}
]
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"@value": [
"GQOMRUQZQBMANH-UHFFFAOYSA-N",
"QGKPUZOFTJQTHL-UHFFFAOYSA-M"
],
"attested_by": {
"QGKPUZOFTJQTHL-UHFFFAOYSA-M": [
"enrich_references.pubchem_semantic"
],
"GQOMRUQZQBMANH-UHFFFAOYSA-N": [
"rdkit_post_consensus"
]
},
"rdfs:label": "InChIKey",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:23666695"
],
"prov:wasDerivedFrom": "pubchem.props.InChIKey"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"N#Cc1cc(I)c(O)c(I)c1.[Na]"
]
}
]
},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"rdfs:label": "SMILES",
"@value": [
"N#Cc1cc(I)c(O)c(I)c1.[Na]"
],
"provenance": [
{
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"Sodium 4-hydroxy-3,5-diiodophenylcyanide"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"N#Cc1cc(I)c(O)c(I)c1.[Na]"
]
}
],
"attested_by": {
"N#Cc1cc(I)c(O)c(I)c1.[Na]": [
"opsin_iupac",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"rdfs:label": "InChI",
"@value": [
"InChI=1S/C7H3I2NO.Na/c8-5-1-4(3-10)2-6(9)7(5)11;/h1-2,11H;"
],
"provenance": [
{
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"Sodium 4-hydroxy-3,5-diiodophenylcyanide"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"N#Cc1cc(I)c(O)c(I)c1.[Na]"
]
}
],
"attested_by": {
"InChI=1S/C7H3I2NO.Na/c8-5-1-4(3-10)2-6(9)7(5)11;/h1-2,11H;": [
"opsin_iupac",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"rdfs:label": "IUPAC name",
"@value": [
"Sodium 4-hydroxy-3,5-diiodophenylcyanide"
],
"provenance": {
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"Sodium 4-hydroxy-3,5-diiodophenylcyanide"
]
},
"attested_by": {
"Sodium 4-hydroxy-3,5-diiodophenylcyanide": [
"opsin_iupac"
]
}
}
},
"references": [
{
"@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.043K",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:23666695;CAS:2961-62-8"
],
"prov:wasDerivedFrom": "pubchem.identifiers[2961-62-8]"
}
},
{
"@id": "https://chem.echa.europa.eu/100.019.087",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:23666695;CAS:2961-62-8"
],
"prov:wasDerivedFrom": "pubchem.identifiers[2961-62-8]"
}
},
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=2961-62-8",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.consensus_cas_link",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"2961-62-8"
],
"prov:wasDerivedFrom": "cas_numbers"
}
},
{
"@id": "https://comptox.epa.gov/dashboard/DTXSID0058354",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:23666695;CAS:2961-62-8"
],
"prov:wasDerivedFrom": "pubchem.identifiers[2961-62-8]"
}
},
{
"@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/YJ5PH80ES6",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:23666695;CAS:2961-62-8"
],
"prov:wasDerivedFrom": "pubchem.identifiers[2961-62-8]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/compound/23666695",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_compound",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:23666695;CAS:2961-62-8"
],
"prov:wasDerivedFrom": "pubchem.by_cas[2961-62-8]"
}
},
{
"@id": "https://www.wikidata.org/wiki/Q27294544",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:23666695;CAS:2961-62-8"
],
"prov:wasDerivedFrom": "pubchem.identifiers[2961-62-8]"
}
}
],
"prefLabel": [
{
"@value": "Sodium 4-hydroxy-3,5-diiodophenylcyanide",
"@language": "en",
"source": {
"prov:wasGeneratedBy": "bootstrap_labels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "legacy name field"
}
}
],
"@type": [
"https://w3id.org/chemrof/MolecularComplex"
],
"http://www.w3.org/2004/02/skos/core#definition": [],
"uuid": "73aa0ae5-013f-49c6-9939-72550f65307c",
"identifier": "73aa0ae5-013f-49c6-9939-72550f65307c",
"source": "EF 3.1",
"cas_numbers": [
"2961-62-8"
],
"ec_numbers": [
"220-995-7"
],
"context": {
"dimension": "Environmental",
"media": "Water",
"water_body": "Ocean"
},
"synonyms": [],
"lcia_methods": [
{
"method_uuid": "05316e7a-b254-4bea-9cf0-6bf33eb5c630",
"name": "Ecotoxicity, freshwater",
"methodology": "Environmental Footprint",
"impact_category": "Aquatic eco-toxicity",
"impact_indicator": "Comparative Toxic Unit for ecosystems (CTUe) ",
"characterization_factor": 6.4145e-13
},
{
"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": 6.4145e-13
}
],
"unit": "kg",
"input_datasets": [
"EF 3.1"
],
"context_iri": "https://vocab.brightway.one/flow-contexts/envi-wate-ocea",
"unit_iri": "https://vocab.brightway.one/units/unit/KiloGM",
"flow_object_id": "fo-caaf33d7b208785d",
"concept_associations": [
{
"@type": "xkos:ConceptAssociation",
"xkos:sourceConcept": {
"@id": "https://vocab.brightway.one/ef/3.1/flow/73aa0ae5-013f-49c6-9939-72550f65307c",
"skos:prefLabel": "sodium 4-hydroxy-3,5-diiodophenylcyanide",
"context": "Emissions/Emissions to water/Emissions to sea water",
"qudt:hasUnit": {
"@id": "https://vocab.brightway.one/units/unit/KiloGM"
},
"skos:exactMatch": {
"@id": "https://vocab.brightway.dev/elementary-flows/73aa0ae5-013f-49c6-9939-72550f65307c"
}
},
"xkos:targetConcept": {
"@id": "https://vocab.brightway.dev/elementary-flows/73aa0ae5-013f-49c6-9939-72550f65307c"
},
"provenance": {
"prov:wasGeneratedBy": "build_concept_associations",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"https://eplca.jrc.ec.europa.eu/permalink/EF3_1/EF-v3.1.zip"
]
}
}
],
"_sources": {
"prefLabel": "normalize_name_case",
"name": "bootstrap_labels",
"synonyms": "bootstrap_labels",
"context": "default_context_mapping",
"context_iri": "default_context_mapping",
"unit_iri": "unit_normalization",
"ec_numbers": "ec_cross_check",
"properties": "withhold_ambiguous_mass",
"skos_definition": "enrich_references",
"references": "enrich_references",
"altLabel": "consensus_match",
"cas_match_labels": "consensus_match",
"concept_associations": "carry_associations_onto_flows",
"types": "link_flows_to_their_substance"
},
"cas_match_labels": {
"2961-62-8": "exactMatch"
},
"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).",
"_transformed": true,
"_provided": {
"name": "sodium 4-hydroxy-3,5-diiodophenylcyanide",
"synonyms": [
"2,6-Diiodo-4-cyanophenol",
"3,5-Diiodo-4-hydroxybenzonitrile",
"3,5-Dijod-4-hydroxy-benzonitril",
"4-Cyano-2,6-diiodophenol",
"4-Cyano-2,6-dijodphenol",
"4-Hydroxy-3,5-di-iodophenyl cyanide",
"4-Hydroxy-3,5-diiodobenzonitrile",
"AC1L2633",
"ACP 63303",
"Actril",
"Actrilawn",
"BANTROL",
"Bentrol",
"Benzonitrile, 3,5-diiodo-4-hydroxy-",
"Benzonitrile, 4-hydroxy-3,5-diiodo-",
"CA 69-15",
"Certrol",
"Cipotril",
"Iotox",
"Ioxynil",
"Ioxynil [BSI:ISO]",
"Joxynil",
"Loxynil",
"M&B 8873",
"SBB055092",
"Trevespan",
"ioxynil, sodium salt"
],
"context": [
"Emissions",
"Emissions to water",
"Emissions to sea water"
],
"cas_numbers": [
"2961-62-8"
],
"ec_numbers": [],
"unit": "kg"
}
}