Dibromoacetonitrile
fo-dd578954d9ab1318
Identity
- Type
- Neutral molecule
- CAS
- 3252-43-5
- EC
- 221-843-2
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
3- 2,2-Dibromoacetonitrile
- Acetonitrile, 2,2-dibromo-
- Acetonitrile, dibromo-
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | NDSBDLSWTGLNQA-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C2HBr2N/c3-2(4)1-5/h2H |
| IUPAC name chemrof:IUPAC_name | Dibromoacetonitrile |
| Molecular formula chemrof:molecular_formula | C2HBr2N |
| Molecular mass chemrof:molecular_mass | 198.845 |
| Monoisotopic mass chemrof:monoisotopic_mass | 196.84757, 196.847573 |
| SMILES string chemrof:smiles_string | N#CC(Br)Br |
Known URLs
12Where 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=3252-43-5 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:82445 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.019.858 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID3024940 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1462419 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/VGJ91H57XU | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J55.000K | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/C19396 | enrich_references.chebi_xrefs |
| kegg.jp | https://www.kegg.jp/entry/C19396 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/18617 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/erg/#3276 | enrich_references.pubchem_identifier_url |
| Wikidata | https://www.wikidata.org/wiki/Q27155946 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 88172cff-3fe1-4139-a757-6523d602041d | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| b020c7ba-459d-4e21-93e6-e57f6f93a4ab | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 92698b6b-f24e-4cf1-a73f-84a651aef43d | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 71ee9977-b541-4af7-8def-7ad02221bfbb | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 71a8fe44-8fb5-4a87-a490-a1dabbc5d02f | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 68cb23d0-2a6e-42e4-bd5e-734e552db62f | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 9334f48f-5c01-4e2a-aac9-991c5617bfc8 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| 64e77afc-9b44-4026-90dd-8862e28292f6 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| f994daec-ccbd-458f-9445-0e35bc94340d | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 42ba28bb-6932-4e92-a566-e4e9b60271f9 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 9ff18096-1cf2-461b-88b9-87758d3ba743 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| 7582e8da-f932-4ade-a051-c6f031446e31 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 778f7480-44c4-44ef-a9be-0d0dfca5146f | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (55 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