Consensus flow list

O-isopropyl Ethylthiocarbamate

fo-89d18aa13611553c

Identity

Type
NeutralMolecule
CAS
141-98-0
EC
205-517-7
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for O-isopropyl Ethylthiocarbamate

Alternative labels

7

Properties

PropertyValue
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

7

Where 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.org 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)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-89d18aa13611553c",
  "prefLabel": [
    {
      "@value": "O-isopropyl Ethylthiocarbamate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "Carbamic acid, ethylthio-, O-isopropyl ester",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Carbamothioic acid, ethyl-, O-(1-methylethyl) ester",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
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      }
    },
    {
      "@value": "Carbamothioic acid, N-ethyl-, O-(1-methylethyl) ester",
      "@language": "en",
      "@lang": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Ethylthiocarbamic acid, O-isopropyl ester",
      "@language": "en",
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        ],
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      }
    },
    {
      "@value": "O-(1-Methylethyl) N-ethylcarbamothioate",
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    },
    {
      "@value": "O-Isopropyl N-ethylthiocarbamate",
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    },
    {
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}

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