Consensus flow list

Identity

Type
Neutral molecule
CAS
4672-38-2
EC
225-121-8
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for Propylphosphonic Acid

Alternative labels

9

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string NSETWVJZUWGCKE-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C3H9O3P/c1-2-3-7(4,5)6/h2-3H2,1H3,(H2,4,5,6)
IUPAC name chemrof:IUPAC_name Propylphosphonic Acid
Molecular formula chemrof:molecular_formula C3H9O3P
Molecular mass chemrof:molecular_mass 124.076
Monoisotopic mass chemrof:monoisotopic_mass 124.028931
SMILES string chemrof:smiles_string CCCP(=O)(O)O

Known URLs

7

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=4672-38-2 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.022.837 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID20871092 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL125296 enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0256843 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J8.757B enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/204484 enrich_references.pubchem_compound

Elementary flows

13
Flow Context Source Unit CFs
47131281-0ed5-4004-97c7-46a3ded10698 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
afeee4d2-c1a0-4045-8ff1-ed06aec1e2af Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
5d8c3264-ff34-4b7a-8459-7944606e238d Environmental → Air → Indoor EF 3.1 kg 2
9d71003e-689e-4991-8f7d-e0c66de85fd1 Environmental → Air → Long-term EF 3.1 kg 0
b96077a1-bddb-43ae-949a-b6ed8eaa9181 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
9aed492a-6e79-4f9b-8370-9b918a226863 Environmental → Air → Unknown EF 3.1 kg 2
82b6f1c1-4cd5-45f6-b392-756d36a455b5 Environmental → Ground → Agricultural EF 3.1 kg 2
6731ef1e-7815-43a3-a6bd-094c3e28e6ee Environmental → Ground → Non-agricultural EF 3.1 kg 2
55fddc38-08a6-4900-995e-67fdefb561f6 Environmental → Ground → Unknown EF 3.1 kg 2
5f9b6175-06db-4199-8635-acfaf17d103e Environmental → Water → Long-term EF 3.1 kg 0
2a45510f-46d3-490a-a915-0cab68ec0544 Environmental → Water → Ocean EF 3.1 kg 2
2145b1e5-6b57-429a-923b-1109c142fc9e Environmental → Water → Surface water EF 3.1 kg 2
6c6de866-a7e0-4967-86ed-e589b6f9e95a Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-24f84321926e9328",
  "prefLabel": [
    {
      "@value": "Propylphosphonic Acid",
      "@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": "1-Propanephosphonic acid",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:4672-38-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=4672-38-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1-Propylphosphonic acid",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=4672-38-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Dihydrogen propylphosphonate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=4672-38-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "n-Propylphosphonic acid",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "P-Propylphosphonic acid",
      "@language": "en",
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      "provenance": {
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        ],
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      }
    },
    {
      "@value": "Phosphonic acid, P-propyl-",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Phosphonic acid, propyl-",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "PPA",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Propanephosphonic acid",
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  "properties": {
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    },
    "https://w3id.org/chemrof/smiles_string": {
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      "attested_by": {
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    },
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    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
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      "attested_by": {
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  },
  "references": [
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}

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