Consensus flow list

Identity

Type
Neutral molecule
CAS
110-77-0
EC
203-802-0
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for 2-(ethylthio)ethanol

Alternative labels

13

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string LNRIEBFNWGMXKP-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C4H10OS/c1-2-6-4-3-5/h5H,2-4H2,1H3
IUPAC name chemrof:IUPAC_name 2-(ethylthio)ethanol
Molecular formula chemrof:molecular_formula C4H10OS
Molecular mass chemrof:molecular_mass 106.19
Monoisotopic mass chemrof:monoisotopic_mass 106.045236
SMILES string chemrof:smiles_string CCSCCO

Known URLs

9

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=110-77-0 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.003.457 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID3059393 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=57105 enrich_references.pubchem_identifier_url
femaflavor.org https://www.femaflavor.org/flavor-library/ethyl-2-hydroxyethyl-sulfide enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/6091RQ1378 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J53.964C enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/8075 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27263192 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
6e758da7-11db-4c35-ad15-de13145e1803 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
1d158e84-d6e6-4c42-89cb-2f0f381dfe07 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
93ef950b-deae-46bb-b643-71fb2a0cc7b9 Environmental → Air → Indoor EF 3.1 kg 2
03fd308d-bcff-41d5-b017-731fef315722 Environmental → Air → Long-term EF 3.1 kg 0
c1388e70-8bb2-4e12-a0f2-484f45577190 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
5f1ddc2a-7991-4597-8f12-a1f0061ace6f Environmental → Air → Unknown EF 3.1 kg 2
b04d7795-1026-4b82-af62-b9181322ddb9 Environmental → Ground → Agricultural EF 3.1 kg 2
f37adb78-2354-4a6b-9584-85e5dbc72bce Environmental → Ground → Non-agricultural EF 3.1 kg 2
f820212e-841e-493f-9eb8-4816e70af5f9 Environmental → Ground → Unknown EF 3.1 kg 2
e8a9ddcf-9148-40ef-b338-127adaaab997 Environmental → Water → Long-term EF 3.1 kg 0
ae807911-283c-49ae-87c6-05b3f7b16974 Environmental → Water → Ocean EF 3.1 kg 2
bac829c6-3196-40e0-9563-fcb950e2f948 Environmental → Water → Surface water EF 3.1 kg 2
2533fd4c-8362-41e7-8bb3-a0ecadec978d Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-890e82a00288f51d",
  "prefLabel": [
    {
      "@value": "2-(ethylthio)ethanol",
      "@language": "en",
      "@lang": "en",
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        "prov:wasDerivedFrom": "legacy name field"
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  ],
  "altLabel": [
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      "@value": "2-(Ethylsulfanyl)ethan-1-ol",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-(Ethylsulfanyl)ethanol",
      "@language": "en",
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    {
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    {
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    },
    {
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    {
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