Consensus flow list

Identity

Type
NeutralMolecule
CAS
616-47-7
EC
210-484-7
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for 1-methyl-1h-imidazole

Alternative labels

9

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string MCTWTZJPVLRJOU-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C4H6N2/c1-6-3-2-5-4-6/h2-4H,1H3
IUPAC name chemrof:IUPAC_name 1-methyl-1h-imidazole
Molecular formula chemrof:molecular_formula C4H6N2
Molecular mass chemrof:molecular_mass 82.106
Monoisotopic mass chemrof:monoisotopic_mass 82.053098, 82.0531
SMILES string chemrof:smiles_string Cn1ccnc1

Known URLs

18

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:105197 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=616-47-7 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:113454 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.009.532 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID6052291 enrich_references.pubchem_identifier_url
DrugBank https://go.drugbank.com/drugs/DB02671 enrich_references.chebi_xrefs
drugbank.ca https://www.drugbank.ca/drugs/DB02671 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=88064 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL543 enrich_references.pubchem_identifier_url
gmelin gmelin:2403 enrich_references.chebi_xrefs
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/P4617QS63Y enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0243940 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.664K enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=147241 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=66882 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/1390 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q4545792 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/1-methylimidazole enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
e349dc85-6082-4803-bd43-c92cdee57a64 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
b1fe8c0a-f3a1-4752-954a-40ad5aded3a4 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
50aedea6-33e3-43c0-bf5c-8a5b461333e2 Environmental → Air → Indoor EF 3.1 kg 4
2e199fb5-d8d0-4094-813e-b4fd5acc795b Environmental → Air → Long-term EF 3.1 kg 0
0633b871-3af9-41c3-8fe1-7b8c90bcd725 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
d8974d22-b771-4c97-8a72-7dac84ff1b4e Environmental → Air → Unknown EF 3.1 kg 4
603a1038-311b-49c5-b9cd-01ce95f24059 Environmental → Ground → Agricultural EF 3.1 kg 4
556072d6-e53d-4352-86fe-f936c5ffa14e Environmental → Ground → Non-agricultural EF 3.1 kg 4
ced28a65-a8fd-443f-a2fb-c2ac24925c0f Environmental → Ground → Unknown EF 3.1 kg 4
56ac2efd-2ec6-4910-8589-4a651dda6ce4 Environmental → Water → Long-term EF 3.1 kg 0
09b4f350-bd37-493e-8d58-0980754e1294 Environmental → Water → Ocean EF 3.1 kg 4
804b0706-f85c-4678-9fe9-f646daa7dbe1 Environmental → Water → Surface water EF 3.1 kg 4
a92cff22-9dd4-4cd5-b05f-a35a17fc13ea Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON
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