Consensus flow list

Identity

Type
Molecular complex
CAS
144-02-5
EC
205-613-9
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for Barbital Sodium

Alternative labels

21

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string RGHFKWPGWBFQLN-UHFFFAOYSA-M, RTZOEZPIPKDVLT-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C8H12N2O3.Na/c1-3-8(4-2)5(11)9-7(13)10-6(8)12;/h3-4H2,1-2H3,(H2,9,10,11,12,13);
IUPAC name chemrof:IUPAC_name 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5,5-diethyl-, monosodium salt
Molecular formula chemrof:molecular_formula C8H11N2NaO3, C8H11N2O3.Na, C8H12N2NaO3
SMILES string chemrof:smiles_string CCC1(CC)C(=O)NC(=O)NC1=O.[Na]

Known URLs

3

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=144-02-5 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:234044 enrich_references.chebi_id_link
PubMed https://pubmed.ncbi.nlm.nih.gov/38781737 enrich_references.chebi_xrefs

Elementary flows

13
Flow Context Source Unit CFs
0c5fbec1-f8f2-43e9-8292-8cac5cdc8a7d Environmental → Air → Aircraft cruise height EF 3.1 kg 2
708a4364-16d9-411d-b547-47311ace1378 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
a7022eb8-de73-4bec-aeba-78755aef958a Environmental → Air → Indoor EF 3.1 kg 2
fb8f0262-b88a-4a05-bf5f-667c456b3b03 Environmental → Air → Long-term EF 3.1 kg 0
6805023b-71b2-4afc-b62b-6ed7fa8c46de Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
c86ba30c-0578-4dc7-8537-7482634fc1ca Environmental → Air → Unknown EF 3.1 kg 2
dd561364-a890-449b-a642-5c27fe12be4e Environmental → Ground → Agricultural EF 3.1 kg 2
f450d59e-db96-429e-90ba-7f3a9992b25a Environmental → Ground → Non-agricultural EF 3.1 kg 2
f0cfaf5d-e8ff-44c9-9650-21b1dc45cfbd Environmental → Ground → Unknown EF 3.1 kg 2
c0cbf032-bc39-4482-9ccd-f2e80e0decc5 Environmental → Water → Long-term EF 3.1 kg 0
46762ed9-f43d-4cf0-a319-a74de34e78d0 Environmental → Water → Ocean EF 3.1 kg 2
8ed47496-726b-4b9c-b30a-f8bda146163c Environmental → Water → Surface water EF 3.1 kg 2
b50741d8-2f11-4d4a-bb3f-68e51f8f0727 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (58 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-23749a0a9fa8f28e",
  "prefLabel": [
    {
      "@value": "Barbital Sodium",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "bootstrap_labels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "2,4,6(1H,3H,5H)-Pyrimidinetrione, 5,5-diethyl-, monosodium salt",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=144-02-5"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2,4,6(1H,3H,5H)-Pyrimidinetrione, 5,5-diethyl-, sodium salt (1:1)",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Barbital soluble",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Barbitone sodium",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Barbituric acid, 5,5-diethyl-, sodium salt",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Diethylmalonylurea sodium",
      "@language": "en",
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    },
    {
      "@value": "Embinal",
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    },
    {
      "@value": "Medina",
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    },
    {
      "@value": "Medinal",
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    },
    {
      "@value": "Natrinal",
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    {
      "@value": "Nervoseton",
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    {
      "@value": "Sodium 5,5-diethylbarbiturate",
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    },
    {
      "@value": "Sodium barbital",
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      "@value": "Sodium barbitone",
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    },
    {
      "@value": "Sodium diethylbarbiturate",
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    },
    {
      "@value": "Sodium Veronal",
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    },
    {
      "@value": "sodium;5,5-diethyl-4,6-dioxo-1H-pyrimidin-2-olate",
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    },
    {
      "@value": "Soluble barbital",
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    },
    {
      "@value": "Soprinal",
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    },
    {
      "@value": "Thyalone",
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        "C8H11N2NaO3",
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    "http://semanticscience.org/resource/CHEMINF_000447": {
      "@value": [
        "205-613-9"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=205-613-9"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "ec_numbers"
      }
    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
    "https://w3id.org/chemrof/MolecularComplex"
  ]
}

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