N',n'''-methylenebis{1-[3-(hydroxymethyl)-2,5-dioxoimidazolidin-4-yl]urea}
fo-984847bab3c27697
Identity
- Type
- Neutral molecule
- CAS
- 39236-46-9
- EC
- 254-372-6
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 56 across every transformer
Structure
Alternative labels
13- 1,1′-Methylenebis(3-(3-(hydroxymethyl)-2,5-dioxoimidazolidin-4-yl)urea)
- 1-[3-(Hydroxymethyl)-2,5-dioxoimidazolidin-4-yl]-3-[[[3-(hydroxymethyl)-2,5-dioxoimidazolidin-4-yl]carbamoylamino]methyl]urea
- Abiol
- Bis(methylol) imidazolidinyl urea
- Euxyl K 200
- imidazolidinyl urea
- Imidurea
- methanebis(N,N'-(5-ureido-2,4-diketotetrahydroimidazole)-N,N-dimethylol)
- N',N'''-methanediylbis{1-[3-(hydroxymethyl)-2,5-dioxoimidazolidin-4-yl]urea}
- N,N''-methylenebis(N'-(3-(hydroxymethyl)-2,5-dioxo-4-imidazolidinyl)urea)
- N,N′′-Methylenebis[N′-[3-(hydroxymethyl)-2,5-dioxo-4-imidazolidinyl]urea]
- Sepicide CI
- Urea, N,N′′-methylenebis[N′-[3-(hydroxymethyl)-2,5-dioxo-4-imidazolidinyl]-
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | ZCTXEAQXZGPWFG-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C11H16N8O8/c20-2-18-4(6(22)16-10(18)26)14-8(24)12-1-13-9(25)15-5-7(23)17-11(27)19(5)3-21/h4-5,20-21H,1-3H2,(H2,12,14,24)(H2,13,15,25)(H,16,22,26)(H,17,23,27) |
| IUPAC name chemrof:IUPAC_name | N',N'''-methanediylbis{1-[3-(hydroxymethyl)-2,5-dioxoimidazolidin-4-yl]urea} |
| Molecular formula chemrof:molecular_formula | C11H16N8O8 |
| Molecular mass chemrof:molecular_mass | 388.297 |
| Monoisotopic mass chemrof:monoisotopic_mass | 388.109109, 388.10911 |
| SMILES string chemrof:smiles_string | O=C(NCNC(=O)NC1C(=O)NC(=O)N1CO)NC1C(=O)NC(=O)N1CO |
Known URLs
20Where 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:8731946 | enrich_references.chebi_xrefs |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=39236-46-9 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:51805 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.049.411 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID2040151 | enrich_references.pubchem_identifier_url |
| drugbank.ca | https://www.drugbank.ca/drugs/DB14075 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL65433 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/M629807ATL | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J236.023C | enrich_references.pubchem_identifier_url |
| kegg.jp | https://www.kegg.jp/entry/D04513 | enrich_references.pubchem_identifier_url |
| lincs.smallmolecule | lincs.smallmolecule:LSM-5114 | enrich_references.chebi_xrefs |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=57894 | enrich_references.pubchem_identifier_url |
| ncithesaurus.nci.nih.gov | https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C65895 | enrich_references.pubchem_identifier_url |
| patent | patent:US3248285 | enrich_references.chebi_xrefs |
| platform.opentargets.org | https://platform.opentargets.org/drug/CHEMBL65433 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/38258 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=123104 | enrich_references.pubchem_identifier_url |
| rxnav.nlm.nih.gov | https://rxnav.nlm.nih.gov/id/rxnorm/1368885 | enrich_references.pubchem_identifier_url |
| Wikidata | https://www.wikidata.org/wiki/Q2737856 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Imidazolidinyl_urea | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| d3dcf0c3-eef2-451d-a35c-a87da6d9aec2 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 0790c829-aca3-4eb1-a0e1-2a7b28c4925b | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| eaa28bfd-ad5a-421e-aa91-9ffc9cd0c0de | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| e26a7113-36b2-42ba-bdbe-653e3ba660f1 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| e0e6587c-9dd3-449f-9bb4-51f3cd6ed556 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| 900c5cd7-1f2d-4dd3-9ff7-66834280437d | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 1de954dc-83a7-4f3b-91cb-4bdc2bf73fa1 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| bb0c656e-e233-4c54-a44f-a6ea97307bbc | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| aff6298b-7b39-4072-b1e4-f2966b034570 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| af2eeb31-57b1-4e66-bf91-fb145c83a450 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 5865ce6a-1a79-498c-95cb-4c44e4029a09 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| d86bcd1c-ffd2-489a-9b58-b1ef628bd923 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 3cf0849a-65fd-4316-833b-a8cdcc968b6d | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (56 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