4,6-dichloro-5-nitro-2-(propylthio)pyrimidine /n/n
fo-f6265855dd26e696
Identity
- Type
- Neutral molecule
- CAS
- 145783-14-8
- EC
- 700-475-0
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 54 across every transformer
Structure
Alternative labels
4- 4,6-Dichloro-5-nitro-2-(propylthio)pyrimidine
- 4,6-Dichloro-5-nitro-2-propylsulfanylpyrimidine
- 4,6-Dichloro-5-nitro-2-propylthiopyrimidine
- Pyrimidine, 4,6-dichloro-5-nitro-2-(propylthio)-
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | DDEDQHVHVPJFAC-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C7H7Cl2N3O2S/c1-2-3-15-7-10-5(8)4(12(13)14)6(9)11-7/h2-3H2,1H3 |
| IUPAC name chemrof:IUPAC_name | 4,6-Dichloro-5-nitro-2-(propylthio)pyrimidine |
| Molecular formula chemrof:molecular_formula | C7H7Cl2N3O2S |
| Molecular mass chemrof:molecular_mass | 268.125 |
| Monoisotopic mass chemrof:monoisotopic_mass | 266.963603 |
| SMILES string chemrof:smiles_string | CCCSc1nc(Cl)c([N+](=O)[O-])c(Cl)n1 |
Known URLs
7Where 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=145783-14-8 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.149.352 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID50624098 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/SKG6STM2MT | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.688.107B | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/22268924 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q72467129 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| c12ec3e7-47f4-4b6f-a58a-c2df1d63dbc4 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 1d25bf5a-3912-4cfb-9d82-911c2de3c0ac | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 566004a7-62ae-4624-8329-8f79230995e6 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| e9a02ee7-58d6-49c9-95a8-9a2358eca4c3 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| a42e2914-83f0-4d71-ad64-50dd632a6987 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| d2d91a4e-a19e-48b9-a489-7a6f0ff9cc03 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| a13fd251-8f00-4268-9813-9d3a6eed50e7 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| eaa8211c-8df8-4706-92d0-5f934cb65e99 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| b71237bf-6b8b-4ceb-8724-83e960168e7a | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 3ba923d9-fc0f-4c4a-a491-2633a98bf212 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 974b71e5-196d-498a-8e15-b1336569227e | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 2060c470-19dc-40e8-9a5d-e048ee0b861d | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| b51a44b3-ca90-4681-ade0-9cd30f495dd5 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
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