Consensus flow list

Methylguanidine

fo-1fe9cd4ee38e557a

Identity

Type
Neutral molecule
CAS
471-29-4
EC
207-438-3
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for Methylguanidine

Alternative labels

10

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string CHJJGSNFBQVOTG-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C2H7N3/c1-5-2(3)4/h1H3,(H4,3,4,5)
IUPAC name chemrof:IUPAC_name Methylguanidine
Molecular formula chemrof:molecular_formula C2H7N3
Molecular mass chemrof:molecular_mass 73.099
Monoisotopic mass chemrof:monoisotopic_mass 73.063997, 73.064
SMILES string chemrof:smiles_string CNC(=N)N

Known URLs

23

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=471-29-4 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:16628 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.006.764 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID4020872 enrich_references.pubchem_identifier_url
gmelin gmelin:323399 enrich_references.chebi_xrefs
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/5L0H5Q9VAG enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0001522 enrich_references.chebi_xrefs
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J403K enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C02294 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C02294 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=37847 enrich_references.pubchem_identifier_url
MetaCyc https://metacyc.org/compound?orgid=META&id=CPD-593 enrich_references.chebi_xrefs
patent patent:PL391702 enrich_references.chebi_xrefs
pdb-ccd pdb-ccd:MGX enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/10111 enrich_references.pubchem_compound
PubMed https://pubmed.ncbi.nlm.nih.gov/14744621 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/17190852 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/17409514 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/19286340 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/21090628 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/22342614 enrich_references.chebi_xrefs
reaxys reaxys:1738993 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q27102005 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
d2070e62-95c9-4d3e-b69f-318c7e8c3d14 Environmental → Air → Aircraft cruise height EF 3.1 kg 0
37e4b606-2bce-4e6b-b042-de4fbe5622af Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 0
e5f25701-7a28-48a1-9dca-cf3bf70bdd65 Environmental → Air → Indoor EF 3.1 kg 0
712da91d-512e-4ffe-a81c-11e0aaab13be Environmental → Air → Long-term EF 3.1 kg 0
e91d09ba-9886-4ffc-87eb-8ac3ee4f8274 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 0
d406542f-ec7f-45ba-9a55-b02bd1a789c3 Environmental → Air → Unknown EF 3.1 kg 0
d868d507-f467-452d-8a82-875a098333ed Environmental → Ground → Agricultural EF 3.1 kg 0
4411c74c-ef7c-4028-a9ea-7c41ab502eb3 Environmental → Ground → Non-agricultural EF 3.1 kg 0
e6ac6d44-afc3-4088-a508-e30807709a2e Environmental → Ground → Unknown EF 3.1 kg 0
9270d97d-4777-43dd-95f7-adadaddbb69b Environmental → Water → Long-term EF 3.1 kg 0
1c380200-ef35-4ecd-b254-6c6b59267d9f Environmental → Water → Ocean EF 3.1 kg 0
9fb378fa-d967-487b-91fa-5eeac94d90aa Environmental → Water → Surface water EF 3.1 kg 0
f44b1f4f-97e7-4a15-9211-13a343b52e94 Environmental → Water → Unknown EF 3.1 kg 0

History

Everything that changed this substance (58 changes)

Open the changes page

Full record

Flow object JSON 
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