2,3,5,6-tetrachloro-4-nitroanisole
fo-1645b384ee37ea18
Identity
- Type
- Neutral molecule
- CAS
- 2438-88-2
- EC
- —
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 54 across every transformer
Structure
Alternative labels
4- 1,2,4,5-Tetrachloro-3-methoxy-6-nitrobenzene
- Anisole, 2,3,5,6-tetrachloro-4-nitro-
- Benzene, 1,2,4,5-tetrachloro-3-methoxy-6-nitro-
- TCNA
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | BGPPUXMKKQMWLV-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C7H3Cl4NO3/c1-15-7-4(10)2(8)6(12(13)14)3(9)5(7)11/h1H3 |
| IUPAC name chemrof:IUPAC_name | 2,3,5,6-tetrachloro-4-nitroanisole |
| Molecular formula chemrof:molecular_formula | C7H3Cl4NO3 |
| Molecular mass chemrof:molecular_mass | 290.917 |
| Monoisotopic mass chemrof:monoisotopic_mass | 288.886704 |
| SMILES string chemrof:smiles_string | COc1c(Cl)c(Cl)c([N+](=O)[O-])c(Cl)c1Cl |
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=2438-88-2 | enrich_references.consensus_cas_link |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID2021313 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=407047 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL405522 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/AOX0D94LLR | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J7.897B | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/17107 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q27274042 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 905e7fa5-9a0c-407a-ad88-b27b90ea2934 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 0 |
| bd7f4e38-8a95-4340-bfca-68c9903c9092 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 0 |
| 57cbb491-3332-43a0-aa75-eaccffa41126 | Environmental → Air → Indoor | EF 3.1 | kg | 0 |
| b007d56c-e942-4bdf-8f14-f69bf26034c9 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 6b3a9753-00e9-4290-95e7-2a577a4662b6 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 0 |
| 4da0aa76-9011-4f19-a269-e6d367ec6e62 | Environmental → Air → Unknown | EF 3.1 | kg | 0 |
| 2b758f7e-85bb-4314-851c-1a1309a5ea77 | Environmental → Ground → Agricultural | EF 3.1 | kg | 0 |
| 7f019ca6-4c71-4a10-8074-c66e334d7466 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 0 |
| 6876acc1-9215-468f-9c8f-c70a57e47225 | Environmental → Ground → Unknown | EF 3.1 | kg | 0 |
| 01e1ca79-110b-4a00-830b-40fec52febe5 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 61431eba-ae00-4892-9aa2-e83151db3654 | Environmental → Water → Ocean | EF 3.1 | kg | 0 |
| 2258b535-ea9c-408a-a96c-fc4ef649713a | Environmental → Water → Surface water | EF 3.1 | kg | 0 |
| fc4343d0-168c-458d-b72c-449969928641 | Environmental → Water → Unknown | EF 3.1 | kg | 0 |
History
Everything that changed this substance (54 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