1,3-dimethylurea
fo-e421f5a89a92ae34
Identity
- Type
- Neutral molecule
- CAS
- 96-31-1
- EC
- 202-498-7
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 56 across every transformer
Structure
Alternative labels
6- N,N'-dimethylurea
- N,N′-Dimethylurea
- sym-Dimethylurea
- Symmetric dimethylurea
- Urea, 1,3-dimethyl-
- Urea, N,N′-dimethyl-
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | MGJKQDOBUOMPEZ-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C3H8N2O/c1-4-3(6)5-2/h1-2H3,(H2,4,5,6) |
| IUPAC name chemrof:IUPAC_name | 1,3-dimethylurea |
| Molecular formula chemrof:molecular_formula | C3H8N2O |
| Molecular mass chemrof:molecular_mass | 88.11 |
| Monoisotopic mass chemrof:monoisotopic_mass | 88.06366, 88.063663 |
| SMILES string chemrof:smiles_string | CNC(=O)NC |
Known URLs
19Where 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=96-31-1 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:80472 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.002.272 | enrich_references.pubchem_identifier_url |
| chemicalsafety.ilo.org | https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=1745 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID5025156 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=14910 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=24823 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1234380 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/WAM6DR9I4X | enrich_references.pubchem_identifier_url |
| HMDB | https://hmdb.ca/metabolites/HMDB0029198 | enrich_references.chebi_xrefs |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J4.720A | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/C16364 | enrich_references.chebi_xrefs |
| kegg.jp | https://www.kegg.jp/entry/C16364 | enrich_references.pubchem_identifier_url |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=43738 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/7293 | enrich_references.pubchem_compound |
| reaxys | reaxys:1740672 | enrich_references.chebi_xrefs |
| Wikidata | https://www.wikidata.org/wiki/Q419740 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/1,3-Dimethylurea | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Dimethylurea | enrich_references.chebi_xrefs |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 96a3ca93-dba2-46e9-b2cb-4b349cbc6330 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 4069eab6-a5ef-4c86-af2a-6ddc5672623d | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 7d590e74-6d82-4739-8758-4b9d7ea962e5 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| cdf5ecb2-54e6-4ae1-a29d-f108f6c8ba11 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 0abe580b-63c9-4702-a6ec-61660045d651 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| eb838e51-94e9-4204-a27b-8f620a87ec08 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 02f4f4e4-7fef-4b03-88b9-d371fa1aaed7 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| 61f58c5e-b9f6-43b3-a0ec-9fcfa6deb108 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 6f0d4b44-00bf-4369-9ee6-6cc5966482d6 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| b43ac565-a1b8-40ca-a44d-aca5aab0e8bd | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 42041970-dec6-45e0-a68e-d29e5c8aa97b | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| a6d84531-a123-464b-b443-dde0b125e00f | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 2d1ce12f-d1bc-43da-ae11-6a512dea4a01 | 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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},
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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