Consensus flow list

N-methylmorpholine N-oxide

fo-2a6687152d06fcea

Identity

Type
Neutral molecule
CAS
7529-22-8
EC
231-391-8
Origin
EF 3.1 hybrid_name_cas_v1
Changes
57 across every transformer

Structure

Structure diagram for N-methylmorpholine N-oxide

Alternative labels

8

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string LFTLOKWAGJYHHR-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C5H11NO2/c1-6(7)2-4-8-5-3-6/h2-5H2,1H3
IUPAC name chemrof:IUPAC_name N-methylmorpholine N-oxide
Molecular formula chemrof:molecular_formula C5H11NO2
Molecular mass chemrof:molecular_mass 117.148
Monoisotopic mass chemrof:monoisotopic_mass 117.078979, 117.07898
SMILES string chemrof:smiles_string C[N+]1([O-])CCOCC1

Known URLs

15

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
beilstein beilstein:507437 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=7529-22-8 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:52093 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.028.538 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID3029287 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=73198 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=82153 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3184330 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/ARC64PKJ0F enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J256.599D enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=58088 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/82029 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=125463 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q416248 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/N-Methylmorpholine_N-oxide enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
35abf4bc-1f80-4650-8011-bcf98b536fde Environmental → Air → Aircraft cruise height EF 3.1 kg 4
65e25ee4-bba7-4142-85cf-760f0970445e Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
f69609fa-79b9-4c36-b0df-9f2731051928 Environmental → Air → Indoor EF 3.1 kg 4
c777e653-7ea3-4309-827c-62f6464e0caa Environmental → Air → Long-term EF 3.1 kg 0
6b1fce50-04cb-4d39-98ce-c7220188220f Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
92c679d3-624b-4095-81ec-ddccf9a3f722 Environmental → Air → Unknown EF 3.1 kg 4
950d3d69-21f3-4018-95b7-d1e545d9a5f0 Environmental → Ground → Agricultural EF 3.1 kg 4
fa9592ca-fd6c-4228-bab6-cf331feedb0e Environmental → Ground → Non-agricultural EF 3.1 kg 4
1b21d72b-970c-4a2e-b33c-0cdcabb199cc Environmental → Ground → Unknown EF 3.1 kg 4
419fd06d-0c54-4c57-822c-ea04d55255f9 Environmental → Water → Long-term EF 3.1 kg 0
f57f6f62-afb2-4916-b5c9-237dd8a982fb Environmental → Water → Ocean EF 3.1 kg 4
26113566-93bb-4b70-a512-0e718f1f59e6 Environmental → Water → Surface water EF 3.1 kg 4
70aee805-1547-4fe8-8688-fdaad441b034 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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}

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