Beta-bromo-beta-nitrostyrene
fo-8bd36f021f3a57d0
Identity
- Type
- Neutral molecule
- CAS
- 7166-19-0
- EC
- 230-515-8
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
10- (2-Bromo-2-nitroethenyl)benzene
- 1-Bromo-1-nitro-2-phenylethane
- 1-Bromo-1-nitro-2-phenylethene
- 1-Bromo-1-nitro-2-phenylethylene
- Benzene, (2-bromo-2-nitroethenyl)-
- Bromonitrostyrene
- Giv-gard
- Styrene, β-bromo-β-nitro-
- β-Bromo-β-nitrostyrene
- β-Bromonitrostyrene
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | SKDNDVDHYMEGNJ-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C8H6BrNO2/c9-8(10(11)12)6-7-4-2-1-3-5-7/h1-6H |
| IUPAC name chemrof:IUPAC_name | Beta-bromo-beta-nitrostyrene |
| Molecular formula chemrof:molecular_formula | C8H6BrNO2 |
| Molecular mass chemrof:molecular_mass | 228.045 |
| Monoisotopic mass chemrof:monoisotopic_mass | 226.958191 |
| SMILES string chemrof:smiles_string | O=[N+]([O-])C(Br)=Cc1ccccc1 |
Known URLs
5Where 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=7166-19-0 | enrich_references.consensus_cas_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.027.742 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID3024653 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/23555 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q106627874 | enrich_references.pubchem_identifier_url |
Elementary flows
14| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 290550f4-6556-11dd-ad8b-0800200c9a66 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 08a91e70-3ddc-11dd-9d4b-0050c2490048 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 3790058f-2be3-4d8d-a8e5-5cf24232a5d5 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| fe0acd60-3ddc-11dd-b193-0050c2490048 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 08a91e70-3ddc-11dd-9d4c-0050c2490048 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| fe0acd60-3ddc-11dd-b192-0050c2490048 | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| fe0acd60-3ddc-11dd-b190-0050c2490048 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| fe0acd60-3ddc-11dd-b195-0050c2490048 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| fe0acd60-3ddc-11dd-b191-0050c2490048 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 08a91e70-3ddc-11dd-9d4e-0050c2490048 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| fe0acd60-3ddc-11dd-b196-0050c2490048 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| 08a91e70-3ddc-11dd-9d4d-0050c2490048 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 0131a7c75023901fb84f59c6254f7451ef48356c | Environmental → Water → Unconfined aquifer | stepwise algorithm addition | kg | 0 |
| fe0acd60-3ddc-11dd-b194-0050c2490048 | 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?
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- This is not that chemical
- This record is two substances, or it is a second copy of one
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