O-isopropyl Ethylthiocarbamate
fo-89d18aa13611553c
Identity
- Type
- Neutral molecule
- CAS
- 141-98-0
- EC
- 205-517-7
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
7- Carbamic acid, ethylthio-, O-isopropyl ester
- Carbamothioic acid, ethyl-, O-(1-methylethyl) ester
- Carbamothioic acid, N-ethyl-, O-(1-methylethyl) ester
- Ethylthiocarbamic acid, O-isopropyl ester
- O-(1-Methylethyl) N-ethylcarbamothioate
- O-Isopropyl N-ethylthiocarbamate
- O-Isopropyl N-ethylthionocarbamate
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | KIACEOHPIRTHMI-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C6H13NOS/c1-4-7-6(9)8-5(2)3/h5H,4H2,1-3H3,(H,7,9) |
| IUPAC name chemrof:IUPAC_name | O-isopropyl Ethylthiocarbamate |
| Molecular formula chemrof:molecular_formula | C6H13NOS |
| Molecular mass chemrof:molecular_mass | 147.243 |
| Monoisotopic mass chemrof:monoisotopic_mass | 147.071785 |
| SMILES string chemrof:smiles_string | CCNC(=S)OC(C)C |
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=141-98-0 | enrich_references.consensus_cas_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.005.016 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID7027093 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/H67Z2VP9UI | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J193.632H | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/3032295 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q27279697 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 011c90ec-856f-4afb-b9a3-9112e3773a8c | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 82babc89-cd3f-4d72-9d34-4585330830ee | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 9860a965-d90f-495e-bfb2-11200886dbc0 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| 023ba0ef-270f-4d0e-8ba9-0bc90ca2c1ff | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| fbabb3b8-ff7a-4526-9b62-baa9ff7d5c5a | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| b3fd8e3a-70c4-41be-bb24-4b8fb5fbc5e3 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 5e6531af-b5b3-45cc-8b78-63b958497017 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| ee68622e-5fa5-41c1-a5e7-0b65edcc7285 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| ec2b1b09-271d-47b4-99fa-9635d5d93019 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 46cd3e4a-b69d-499c-b700-a493af265984 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| c799219b-96b0-4756-9673-6cb5228059c5 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 1993eb0c-cc15-4194-9ec5-8462b04d8ddd | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| a9605f6a-cbfb-4e29-b98f-a5d6d34c72db | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
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