1H-1,4-diazepine, Hexahydro-1,4-dinitroso-
fo-e658ff54a0fe7ff0
Identity
- Type
- Neutral molecule
- CAS
- 55557-00-1
- EC
- —
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 64 across every transformer
Structure
Alternative labels
3- 1,4-Dinitroso-[1,4]diazepane
- Dinitrosohomopiperazine
- Hexahydro-1,4-dinitroso-1H-1,4-diazepine
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | FUCMFBXWLUGVIZ-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C5H10N4O2/c10-6-8-2-1-3-9(7-11)5-4-8/h1-5H2 |
| IUPAC name chemrof:IUPAC_name | 1H-1,4-diazepine, Hexahydro-1,4-dinitroso-, 1h-1,4-diazepine, Hexahydro-1,4-dinitroso- |
| Molecular formula chemrof:molecular_formula | C5H10N4O2 |
| Molecular mass chemrof:molecular_mass | 158.161 |
| Monoisotopic mass chemrof:monoisotopic_mass | 158.080376 |
| SMILES string chemrof:smiles_string | O=NN1CCCN(N=O)CC1 |
Known URLs
8Where 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=55557-00-1 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.383.685 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID0020525 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL164341 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/FH496MRM5J | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J57.936J | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/41473 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q63088199 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 682ec185-8b9a-4c7f-9a05-dc66427e33d1 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 34ebed0b-3ba7-4f51-9cca-12165a97f8db | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 4cf9bd95-9d8d-48c7-9a6c-7d1eae09f5a7 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| e3cf0836-098b-4593-a16f-a0047afc4185 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| bb414c60-43c0-48fc-b7fb-9dfe696b6767 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 099c06ee-5060-4df6-9575-c6161a8cd206 | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 4ff19b67-da3a-478c-8764-1feb06b1afd6 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| 1635ecbf-f713-41a5-9337-095f7899fb1f | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| 37d5ed11-e9e3-4dfc-b86c-9ccd8e43cd81 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| f972becf-05d6-4593-b0bf-f3ee4a7dddaa | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 3d393fa8-31e5-411a-94a1-797956baec33 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| 69b0c646-6f83-4565-90ea-744a94dab8aa | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| b81c4c7d-8b27-4544-a291-9c3d61dbdc18 | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (64 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