Consensus flow list

Identity

Type
Neutral molecule
CAS
112-50-5
EC
203-978-9
Origin
EF 3.1 hybrid_name_cas_v1
Changes
53 across every transformer

Structure

Structure diagram for 2-[2-(2-ethoxyethoxy)ethoxy]ethanol

Alternative labels

10

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string WFSMVVDJSNMRAR-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C8H18O4/c1-2-10-5-6-12-8-7-11-4-3-9/h9H,2-8H2,1H3
IUPAC name chemrof:IUPAC_name 2-[2-(2-ethoxyethoxy)ethoxy]ethanol
Molecular formula chemrof:molecular_formula C8H18O4
Molecular mass chemrof:molecular_mass 178.228
Monoisotopic mass chemrof:monoisotopic_mass 178.120509
SMILES string chemrof:smiles_string CCOCCOCCOCCO

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=112-50-5 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.003.617 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0718 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID3024368 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1900144 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/4G0E2G9582 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J22.129E enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/8190 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q2379098 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
79e4fd9a-be3d-461b-b721-2b82b1ee91a6 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
03aef204-4a7e-4e0e-85bb-1e13a3f47de9 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
1e804194-581a-4eee-a7ef-a35c97a2bb30 Environmental → Air → Indoor EF 3.1 kg 4
4cf93cd1-5c0f-46f9-9427-e7f4f0743cef Environmental → Air → Long-term EF 3.1 kg 0
d8f066cb-f677-4f16-942a-45df8b00e71a Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
3b5adab1-f624-44a0-858b-88ee33e18d1f Environmental → Air → Unknown EF 3.1 kg 4
bbfa7e49-7d03-47a1-8743-60657871d2f1 Environmental → Ground → Agricultural EF 3.1 kg 4
712375da-f604-4cd3-a657-0063b90c9d2c Environmental → Ground → Non-agricultural EF 3.1 kg 4
2fa1832b-64a0-4722-b6dc-ae13b6e715e5 Environmental → Ground → Unknown EF 3.1 kg 4
5a9a90ef-cb98-4e8d-8932-4ef6121725e1 Environmental → Water → Long-term EF 3.1 kg 0
abdcde00-102f-4c7c-a8c5-077b6b02e617 Environmental → Water → Ocean EF 3.1 kg 4
88715545-6821-4a21-9c52-dcdfcb67f4dd Environmental → Water → Surface water EF 3.1 kg 4
71067008-271e-4c53-95e7-c4aa22ebbcde Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (53 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-aef68587f6461a97",
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    {
      "@value": "2-[2-(2-ethoxyethoxy)ethoxy]ethanol",
      "@language": "en",
      "@lang": "en",
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  "altLabel": [
    {
      "@value": "12: PN: WO2017021334 SEQID: 18 claimed sequence",
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      }
    },
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      "@value": "3,6,9-Trioxaundecan-1-ol",
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    },
    {
      "@value": "Ethanol, 2-[2-(2-ethoxyethoxy)ethoxy]-",
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    {
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    },
    {
      "@value": "Triethylene glycol monoethyl ether",
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