Dinoseb
fo-2df8570cf5c5f1f1
Identity
- Type
- Neutral molecule
- CAS
- 88-85-7
- EC
- 201-861-7
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 57 across every transformer
Structure
What it is used for
3
Roles, not types. A substance bears as many as apply — sulfluramid is an
insecticide and an acaricide — and each is a class ChEBI curates, asserted
with ChEBI’s own has role. The narrow ones publish the broad
ones alongside them, so a substance filed as a herbicide is a pesticide
here too. See agricultural
chemicals for what the axis is and which classes are published.
| Role | Definition | Evidence |
|---|---|---|
| environmental contaminant CHEBI:78298 | Any minor or unwanted substance introduced into the environment that can have undesired effects. | ChEBI |
| herbicide CHEBI:24527 | A substance used to destroy plant pests. | ChEBI |
| pesticide CHEBI:25944 | Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests. | ChEBI |
Alternative labels
34- (+-)-2-(1-Methylpropyl)-4,6-dinitrophenol
- (RS)-2-sec-butyl-4,6-dinitrophenol
- 2,4-Dinitro-6-(1-methylpropyl)phenol
- 2,4-Dinitro-6-sec-butylphenol
- 2-(1-Methylpropyl)-4,6-dinitrophenol
- 2-sec-Butyl-4,6-dinitrophenol
- 4,6-Dinitro-2-(1-methyl-n-propyl)phenol
- 4,6-Dinitro-2-(2-butyl)phenol
- 4,6-Dinitro-2-sec-butylphenol
- 4,6-dinitro-o-sec-butylphenol
- 6-sec-Butyl-2,4-dinitrophenol
- Aatox
- Blaartox
- Butaphen
- Butaphene
- Chemox P.E.
- DBNF
- Desicoil
- Dibutox
- Dibutox 20CE
- DNBP
- DNOSBP
- DNSBP
- Dow General
- Dytop
- Hivertox
- Ladob
- Laseb
- Liro DNBP
- Phenol, 2-(1-methylpropyl)-4,6-dinitro-
- Phenol, 2-sec-butyl-4,6-dinitro-
- Premerge
- rac-2-(butan-2-yl)-4,6-dinitrophenol
- Super Kabrol
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | OWZPCEFYPSAJFR-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C10H12N2O5/c1-3-6(2)8-4-7(11(14)15)5-9(10(8)13)12(16)17/h4-6,13H,3H2,1-2H3 |
| IUPAC name chemrof:IUPAC_name | (+-)-2-(1-Methylpropyl)-4,6-dinitrophenol |
| Molecular formula chemrof:molecular_formula | C10H12N2O5 |
| Molecular mass chemrof:molecular_mass | 240.213, 240.215 |
| Monoisotopic mass chemrof:monoisotopic_mass | 240.07462, 240.074621 |
| SMILES string chemrof:smiles_string | CCC(C)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O |
Known URLs
10Where 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=88-85-7 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:34719 | enrich_references.chebi_id_link |
| HMDB | https://hmdb.ca/metabolites/HMDB0032559 | enrich_references.chebi_xrefs |
| KEGG | https://www.genome.jp/entry/C14302 | enrich_references.chebi_xrefs |
| pesticides | pesticides:dinoseb | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/22536127 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/23470868 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/24034831 | enrich_references.chebi_xrefs |
| reaxys | reaxys:2058234 | enrich_references.chebi_xrefs |
| Wikipedia | https://en.wikipedia.org/wiki/Dinoseb | enrich_references.chebi_xrefs |
Elementary flows
15| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| e2fb2be1-6555-11dd-ad8b-0800200c9a66 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 08a91e70-3ddc-11dd-94cb-0050c2490048 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| d608e649-4ad1-4090-98d6-7574986396fe | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| 08a91e70-3ddc-11dd-94ca-0050c2490048 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 4d9a8790-3ddd-11dd-94ed-0050c2490048 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| 08a91e70-3ddc-11dd-94c9-0050c2490048 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 08a91e70-3ddc-11dd-94c7-0050c2490048 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| 4d9a8790-3ddd-11dd-94f1-0050c2490048 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 82c638d2ef816e7a81be5be19f7e937850e62757 | Environmental → Ground → Silvicultural | ecoinvent algorithm addition | kg | 0 |
| 08a91e70-3ddc-11dd-94c8-0050c2490048 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 4d9a8790-3ddd-11dd-94ef-0050c2490048 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 4d9a8790-3ddd-11dd-94f2-0050c2490048 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 4d9a8790-3ddd-11dd-94ee-0050c2490048 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 0313a300eb3e8f3b47064f89a7253fad9dfcafae | Environmental → Water → Unconfined aquifer | stepwise algorithm addition | kg | 0 |
| 4d9a8790-3ddd-11dd-94f0-0050c2490048 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (57 changes)
Full record
Flow object JSON
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{
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{
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{
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{
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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