Consensus flow list

Identity

Type
Neutral molecule
CAS
924-16-3
EC
213-101-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
57 across every transformer

Structure

Structure diagram for Nitrosodibutylamine

Alternative labels

13

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string YGJHZCLPZAZIHH-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C8H18N2O/c1-3-5-7-10(9-11)8-6-4-2/h3-8H2,1-2H3
IUPAC name chemrof:IUPAC_name Nitrosodibutylamine
Molecular formula chemrof:molecular_formula C8H18N2O
Molecular mass chemrof:molecular_mass 158.245
Monoisotopic mass chemrof:monoisotopic_mass 158.14191, 158.141913
SMILES string chemrof:smiles_string CCCCN(CCCC)N=O

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
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=924-16-3 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:82356 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.011.911 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID2021026 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=6830 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL354920 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/8K8942WN31 enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0255202 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.346D enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C19277 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C19277 enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C44418 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/13542 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#3082 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q22138402 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
172b00fc-6556-11dd-ad8b-0800200c9a66 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
4d9a8790-3ddd-11dd-9483-0050c2490048 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
f102348a-e4db-47c4-a690-bd1e10bf7f72 Environmental → Air → Indoor EF 3.1 kg 2
4d9a8790-3ddd-11dd-9482-0050c2490048 Environmental → Air → Long-term EF 3.1 kg 0
4d9a8790-3ddd-11dd-9484-0050c2490048 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
4d9a8790-3ddd-11dd-9481-0050c2490048 Environmental → Air → Unknown EF 3.1 kg 2
4d9a8790-3ddd-11dd-947f-0050c2490048 Environmental → Ground → Agricultural EF 3.1 kg 2
08a91e70-3ddc-11dd-a2c4-0050c2490048 Environmental → Ground → Non-agricultural EF 3.1 kg 2
4d9a8790-3ddd-11dd-9480-0050c2490048 Environmental → Ground → Unknown EF 3.1 kg 2
08a91e70-3ddc-11dd-a2c2-0050c2490048 Environmental → Water → Long-term EF 3.1 kg 0
08a91e70-3ddc-11dd-a2c5-0050c2490048 Environmental → Water → Ocean EF 3.1 kg 2
4d9a8790-3ddd-11dd-9485-0050c2490048 Environmental → Water → Surface water EF 3.1 kg 2
08a91e70-3ddc-11dd-a2c3-0050c2490048 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (57 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-c483cc0b9569d8c9",
  "prefLabel": [
    {
      "@value": "Nitrosodibutylamine",
      "@language": "en",
      "@lang": "en",
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        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "1-Butanamine, N-butyl-N-nitroso-",
      "@language": "en",
      "@lang": "en",
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      }
    },
    {
      "@value": "Di-n-butylnitrosamine",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Dibutylamine, N-nitroso-",
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      "@lang": "en",
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    },
    {
      "@value": "Dibutylnitrosamine",
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      }
    },
    {
      "@value": "N,N-Di-n-butylnitrosamine",
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    },
    {
      "@value": "N,N-Dibutylnitrosamine",
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    },
    {
      "@value": "N,N-Dibutylnitrosoamine",
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    {
      "@value": "N,N-Dibutylnitrous amide",
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    },
    {
      "@value": "N-Butyl-N-nitroso-1-butanamine",
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    },
    {
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    {
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    {
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