1,5-dichloro-2,4-dinitrobenzene
fo-91ddf2eeceeccbec
Identity
- Type
- Neutral molecule
- CAS
- 3698-83-7
- EC
- 223-027-1
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
6- 1,3-Dichloro-4,6-dinitrobenzene
- 2,4-Dichloro-1,5-dinitrobenzene
- 2,6-Dichloro-3,5-dinitrobenzene
- 4,6-Dichloro-1,3-dinitrobenzene
- 4,6-Dinitro-1,3-dichlorobenzene
- Benzene, 1,5-dichloro-2,4-dinitro-
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | ZPXDNSYFDIHPOJ-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C6H2Cl2N2O4/c7-3-1-4(8)6(10(13)14)2-5(3)9(11)12/h1-2H |
| IUPAC name chemrof:IUPAC_name | 1,5-dichloro-2,4-dinitrobenzene |
| Molecular formula chemrof:molecular_formula | C6H2Cl2N2O4 |
| Molecular mass chemrof:molecular_mass | 236.998 |
| Monoisotopic mass chemrof:monoisotopic_mass | 235.939162 |
| SMILES string chemrof:smiles_string | O=[N+]([O-])c1cc([N+](=O)[O-])c(Cl)cc1Cl |
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=3698-83-7 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.020.934 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID6022210 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=28971 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/6ENC7C8ZR0 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J205.612G | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/77286 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q27264726 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 5d2f88ca-be5a-4a8b-a63d-3467ffc7a8da | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 14411f6a-5786-480f-ad9c-2f11fe62fae7 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| ca0d7fce-b457-4ba3-869a-e416b4efbab8 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 24ab8b89-0092-48e0-a98a-b76962ceb534 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| ffea1173-6468-4f10-8bd1-a074efa2e1e7 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| e65940b1-c124-452b-a3dd-133d14fcf0b5 | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| f68b9647-6a49-4c2f-a96d-b6ab0f1d8f94 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| d6e3ea76-4e0e-4b5b-94d3-8730cea5f9df | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| c847f8d6-ef4e-4c45-b464-d65718ab6f1e | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| ff7f5cc6-dfa8-4306-9515-812222763df9 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 4c787df2-3b70-4d14-86dd-40a753b8c19d | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| 951485ec-d6b5-4480-b54f-16eea7d2a26d | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 24253148-471b-433a-90ac-0bf4ff71fc03 | 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