Zytron
fo-e9c3aea83a507131
Identity
- Type
- Neutral molecule
- CAS
- 299-85-4
- EC
- —
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 54 across every transformer
Structure
Alternative labels
7- DMPA (herbicide)
- O-(2,4-Dichlorophenyl) O-methyl isopropylphosphoramidothioate
- O-(2,4-Dichlorophenyl) O-methyl N-isopropylphosphoramidothioate
- Phenol, 2,4-dichloro-, O-ester with O-Me isopropylphosphoramidothioate
- Phosphoramidothioic acid, (1-methylethyl)-, O-(2,4-dichlorophenyl) O-methyl ester
- Phosphoramidothioic acid, isopropyl-, O-(2,4-dichlorophenyl) O-methyl ester
- Phosphoramidothioic acid, N-(1-methylethyl)-, O-(2,4-dichlorophenyl) O-methyl ester
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | PJFGPJQBWSEWKX-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C10H14Cl2NO2PS/c1-7(2)13-16(17,14-3)15-10-5-4-8(11)6-9(10)12/h4-7H,1-3H3,(H,13,17) |
| IUPAC name chemrof:IUPAC_name | O-(2,4-Dichlorophenyl) O-methyl N-isopropylphosphoramidothioate |
| Molecular formula chemrof:molecular_formula | C10H14Cl2NO2PS |
| Molecular mass chemrof:molecular_mass | 314.174 |
| Monoisotopic mass chemrof:monoisotopic_mass | 312.985992 |
| SMILES string chemrof:smiles_string | COP(=S)(NC(C)C)Oc1ccc(Cl)cc1Cl |
Known URLs
11Where 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=299-85-4 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID1058052 | enrich_references.pubchem_identifier_url |
| drugbank.ca | https://www.drugbank.ca/drugs/DB11768 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/IK51552IFH | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J5.471B | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J57.963G | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J57.964E | enrich_references.pubchem_identifier_url |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=152869 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/9299 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q27280764 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Zytron | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 9607b0c3-0bee-4937-acfd-b98ba42fa30f | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| fc9325d2-1933-4aa7-a109-8c2dec03a4ef | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 842102b3-2764-4fd8-956e-6133676dd2e3 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 48968808-437c-4db5-8fee-72ce08c3b82c | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 49070d3d-3c4d-4975-9e2f-59dc5b37e61b | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 5ba88431-3f3b-489a-9ca7-7a89afc3a288 | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 47f4ed3d-6c99-497c-93f4-820f54fb26ae | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| d4f0f645-1868-4bae-98c6-95584e5669fa | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| 130ba2fa-5a4e-48a2-8d3b-19e5705a9967 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 65b51c77-6503-4e83-be58-2d09fab9d823 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| a6564d38-b251-44bf-9645-cf684326235d | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| ad536378-1051-4898-85c1-f4ab5f9362ea | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| afc494b7-ccfa-4d84-9f4e-dfe67c5f498f | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
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