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
Alternative labels
10- 1-METHYLGUANIDINE
- Guanidine, methyl-
- Guanidine, N-methyl-
- MeSH ID: D008760
- Methylguanidin
- MGX
- Monomethyl guanidin
- monomethylguanidine
- N-methylguanidine
- N1-Methylguanidine
Properties
| Property | Value |
|---|---|
| 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
23Where 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 | 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)
Full record
Flow object JSON
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Something wrong here?
- This substance is published under the wrong name
- This is not that chemical
- This record is two substances, or it is a second copy of one
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