Consensus flow list

Identity

Type
ChemicalSalt
CAS
139-33-3
EC
205-358-3
Origin
EF 3.1 hybrid_name_cas_v1
Changes
57 across every transformer

Structure

Structure diagram for Disodium Dihydrogen 2,2',2'',2'''-(ethane-1,2-diyldinitrilo)tetraacetate

Alternative labels

77

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string ZGTMUACCHSMWAC-UHFFFAOYSA-L
InChI2D string chemrof:inchi2d_string InChI=1S/C10H16N2O8.2Na/c13-7(14)3-11(4-8(15)16)1-2-12(5-9(17)18)6-10(19)20;;/h1-6H2,(H,13,14)(H,15,16)(H,17,18)(H,19,20);;/q;2*+1/p-2
IUPAC name chemrof:IUPAC_name Disodium Dihydrogen 2,2',2'',2'''-(ethane-1,2-diyldinitrilo)tetraacetate
Molecular formula chemrof:molecular_formula C10H14N2Na2O8, C10H14N2O8.2Na
Molecular mass chemrof:molecular_mass 336.208
Monoisotopic mass chemrof:monoisotopic_mass 336.05455, 336.054554
SMILES string chemrof:smiles_string O=C([O-])CN(CCN(CC(=O)O)CC(=O)O)CC(=O)[O-].[Na+].[Na+]

Known URLs

8

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource URL Recorded by
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=139-33-3 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:64734 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.004.872 enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0303556 enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/D03945 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/57339238 enrich_references.pubchem_compound
reaxys reaxys:3822669 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q4532977 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
12826e9f-825c-4989-bd19-9139dc5a8841 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
a0f0e677-f2ca-4eec-9643-e20490acf261 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
0c485a02-3989-4f77-a768-7193c221f222 Environmental → Air → Indoor EF 3.1 kg 4
f792abbb-e2c7-464c-a169-46cb235b7c0f Environmental → Air → Long-term EF 3.1 kg 0
67fca086-c5f9-4a6c-aa4f-52a42f833f38 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
977af2a5-afb2-4fdf-b00b-1880a1828eac Environmental → Air → Unknown EF 3.1 kg 4
37be34ff-5155-4cd6-ab6a-45300ec760f9 Environmental → Ground → Agricultural EF 3.1 kg 4
7d53f26e-d409-474a-8bc1-c6aec0903534 Environmental → Ground → Non-agricultural EF 3.1 kg 4
a6e86894-2806-40dd-884c-7a421ba41b8a Environmental → Ground → Unknown EF 3.1 kg 4
a0e29a48-13db-4bba-a444-7df23b81ad74 Environmental → Water → Long-term EF 3.1 kg 0
57421811-c450-40a6-8659-2397ca20eeb7 Environmental → Water → Ocean EF 3.1 kg 4
7237e699-c391-4207-8691-8b169aa8f877 Environmental → Water → Surface water EF 3.1 kg 4
b8aa39a3-3c10-451d-aef5-569b1bb319d8 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (57 changes)

Open the changes page

Full record

Flow object JSON
{
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      "@value": "Clewat PC-N 06771",
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    {
      "@value": "disodium 2,2',2'',2'''-(ethane-1,2-diyldiammonio)tetraacetate",
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    },
    {
      "@value": "Disodium diacid ethylenediaminetetraacetate",
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    },
    {
      "@value": "Disodium dihydrogen ethylenediaminetetraacetate",
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    },
    {
      "@value": "Disodium edathamil",
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      }
    },
    {
      "@value": "disodium edetate",
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "disodium edetate (anh.)",
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    },
    {
      "@value": "disodium edetate (anhydrous)",
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    },
    {
      "@value": "disodium EDTA",
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    {
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Disodium ethylenediamine-N,N,N′,N′-tetraacetate",
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      }
    },
    {
      "@value": "Disodium ethylenediaminetetraacetate",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Disodium ethylenediaminetetraacetic acid salt",
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          "https://commonchemistry.cas.org/detail?cas_rn=139-33-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Disodium sequestrene",
      "@language": "en",
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          "https://commonchemistry.cas.org/detail?cas_rn=139-33-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Disodium tetracemate",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Disodium versenate",
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          "https://commonchemistry.cas.org/detail?cas_rn=139-33-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Disodium versene",
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          "https://commonchemistry.cas.org/detail?cas_rn=139-33-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Dissolvine Na 2T",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Dissolvine Na 2x",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Dissolvine Na2",
      "@language": "en",
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        ],
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      }
    },
    {
      "@value": "Dissolvine Na2S",
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      }
    },
    {
      "@value": "Dotite 2NA",
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    },
    {
      "@value": "Edathamil disodium",
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        ],
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      }
    },
    {
      "@value": "Edeta BD",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "edetate disodium",
      "@language": "en",
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "edetate disodium (anh.)",
      "@language": "en",
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      "provenance": {
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "edetate disodium (anhydrous)",
      "@language": "en",
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      "provenance": {
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Edetate disodium anhydrous",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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