Consensus flow list

Identity

Type
NeutralMolecule
CAS
5117-12-4
EC
418-140-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 4-(1-oxo-2-propenyl)-morpholine

Alternative labels

20

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string XLPJNCYCZORXHG-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C7H11NO2/c1-2-7(9)8-3-5-10-6-4-8/h2H,1,3-6H2
IUPAC name chemrof:IUPAC_name 4-(1-oxo-2-propenyl)-morpholine
Molecular formula chemrof:molecular_formula C7H11NO2
Molecular mass chemrof:molecular_mass 141.17
Monoisotopic mass chemrof:monoisotopic_mass 141.078979
SMILES string chemrof:smiles_string C=CC(=O)N1CCOCC1

Known URLs

11

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=28902-82-1 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=5117-12-4 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.101.697 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.111.433 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID0044947 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=162221 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3187188 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/K0Y58P61JA enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J87.318G enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/98723 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27281799 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
e80aa455-3a79-4644-b306-33bd761d0da8 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
d61a2c14-1c0b-4ecb-b1d3-ec8607d512d6 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
b5774b0b-f33a-40ba-ba69-1d2803f940c9 Environmental → Air → Indoor EF 3.1 kg 2
a91855d6-044f-4601-890f-1e638cbeb1df Environmental → Air → Long-term EF 3.1 kg 0
e090dfe9-9a29-4c75-bc23-d408fdf0b16a Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
212dc163-69ce-4d95-baea-dcbbcac72c19 Environmental → Air → Unknown EF 3.1 kg 2
cd597415-64a5-4e48-9658-ffac5a0366a3 Environmental → Ground → Agricultural EF 3.1 kg 2
67e1ac38-4dfd-4f17-b831-3dfbc08c01ad Environmental → Ground → Non-agricultural EF 3.1 kg 2
03ae9825-58a0-4bb5-acf7-cf251902c7c3 Environmental → Ground → Unknown EF 3.1 kg 2
eec68583-34d4-4bd7-9d60-5cbf7bdfae95 Environmental → Water → Long-term EF 3.1 kg 0
7fe6b161-714c-43e0-8ef2-568b028dda55 Environmental → Water → Ocean EF 3.1 kg 2
4b598832-b9d8-41e7-84b2-a7335d46f80f Environmental → Water → Surface water EF 3.1 kg 2
18c4fab3-19d7-4dca-9420-578b5586e977 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-4907c6a0f75bbd7d",
  "prefLabel": [
    {
      "@value": "4-(1-oxo-2-propenyl)-morpholine",
      "@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-(4-Morpholinyl)-2-propen-1-one",
      "@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=5117-12-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1-(Morpholin-4-yl)propenone",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=5117-12-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1-Morpholinoprop-2-en-1-one",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=5117-12-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Propen-1-one, 1-(4-morpholinyl)-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "4-(1-Oxo-2-propenyl)morpholine",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "4-Acryloylmorpholine",
      "@language": "en",
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      }
    },
    {
      "@value": "A-MO",
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      }
    },
    {
      "@value": "ACMO",
      "@language": "en",
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      "provenance": {
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    },
    {
      "@value": "ACMO-LI",
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      }
    },
    {
      "@value": "Acryloylmorpholine",
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    },
    {
      "@value": "JRMer 5102",
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        ],
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      }
    },
    {
      "@value": "Kayarad RM 1001",
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      "@lang": "en",
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        ],
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      }
    },
    {
      "@value": "Kohshylmer ACMO",
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        ],
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      }
    },
    {
      "@value": "LuCure 248",
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    },
    {
      "@value": "Morpholine, 4-(1-oxo-2-propenyl)-",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Morpholine, 4-acryloyl-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "N-Acryloylmorpholine",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "NK Ester A-MO",
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      "@lang": "en",
      "provenance": {
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        ],
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      }
    },
    {
      "@value": "Omnimer ACMO",
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    },
    {
      "@value": "RBL-ACMO",
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  ],
  "properties": {
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        "C7H11NO2"
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    "https://w3id.org/chemrof/smiles_string": {
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      "rdfs:label": "SMILES",
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  },
  "references": [
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