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1-(2-hydroxyethyl)pyrrolidin-2-one

fo-d1909b50365e91f9

Identity

Type
Neutral molecule
CAS
3445-11-2
EC
222-359-4
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 1-(2-hydroxyethyl)pyrrolidin-2-one

Alternative labels

14

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string WDQFELCEOPFLCZ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C6H11NO2/c8-5-4-7-3-1-2-6(7)9/h8H,1-5H2
IUPAC name chemrof:IUPAC_name 1-(2-hydroxyethyl)pyrrolidin-2-one
Molecular formula chemrof:molecular_formula C6H11NO2
Molecular mass chemrof:molecular_mass 129.159
Monoisotopic mass chemrof:monoisotopic_mass 129.078979
SMILES string chemrof:smiles_string O=C1CCCN1CCO

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=3445-11-2 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.020.328 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID7044922 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3185308 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/297G099QOU enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J26.035E enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/76980 enrich_references.pubchem_compound
Wikidata https://www.wikidata.org/wiki/Q27254401 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
13d478f8-4475-467a-bafb-515fd40bf74b Environmental → Air → Aircraft cruise height EF 3.1 kg 2
4417a23f-7dfc-4417-abc4-0fc15b7f437e Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
91e6bee9-f227-4e1c-8c08-f82d53741338 Environmental → Air → Indoor EF 3.1 kg 2
1c2d768d-ff32-4586-9d80-727f765295ae Environmental → Air → Long-term EF 3.1 kg 0
7ac827e1-c54e-47f7-af12-6a96371d742b Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
31f09284-90f8-425c-bfa2-b66aa65f5381 Environmental → Air → Unknown EF 3.1 kg 2
5cb6457b-9ca2-4ca8-89dc-a598ae50ae26 Environmental → Ground → Agricultural EF 3.1 kg 2
fbda635d-b414-47d3-98c4-8788ee469d82 Environmental → Ground → Non-agricultural EF 3.1 kg 2
26bceafb-19e3-4238-8bc6-8b6ebd56c909 Environmental → Ground → Unknown EF 3.1 kg 2
7bd21304-0d74-451e-b068-143d9a824be0 Environmental → Water → Long-term EF 3.1 kg 0
5281227e-655d-4595-925f-a1dae0785ce8 Environmental → Water → Ocean EF 3.1 kg 2
4cc5e60e-1604-48ea-b63c-e5a5dd578032 Environmental → Water → Surface water EF 3.1 kg 2
cad318ca-032b-450d-bd1b-ba259c39b492 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 
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        "prov:wasDerivedFrom": "ec_numbers"
      }
    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ]
}

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You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works

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