Consensus flow list

Identity

Type
NeutralMolecule
CAS
922165-31-9
EC
618-829-7
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for Bis[2-(2-ethoxyethoxy)ethyl] Cyclohexane-1,4-dicarboxylate

Alternative labels

6

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string JNFDQAYPZCYWLD-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C20H36O8/c1-3-23-9-11-25-13-15-27-19(21)17-5-7-18(8-6-17)20(22)28-16-14-26-12-10-24-4-2/h17-18H,3-16H2,1-2H3
IUPAC name chemrof:IUPAC_name Bis[2-(2-ethoxyethoxy)ethyl] Cyclohexane-1,4-dicarboxylate
Molecular formula chemrof:molecular_formula C20H36O8
Molecular mass chemrof:molecular_mass 404.5
Monoisotopic mass chemrof:monoisotopic_mass 404.241018
SMILES string chemrof:smiles_string CCOCCOCCOC(=O)C1CCC(C(=O)OCCOCCOCC)CC1

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=922165-31-9 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.124.471 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID20238929 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/R6MU0U9L45 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.604.634C enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/25116113 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27287859 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
7cdb260a-6a17-4c36-9232-7aa2fad74bc2 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
6cd9e71f-7279-41d4-9f29-f23808408222 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
0b31b37f-88dc-44eb-82b0-d6055dfcee23 Environmental → Air → Indoor EF 3.1 kg 2
3fc456d6-d621-4336-ae82-b3c9a48a1128 Environmental → Air → Long-term EF 3.1 kg 0
0b12050c-ee58-4b22-9492-85a0d37df37c Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
f6fe574d-3198-41f1-ad5f-3d5964f1ce4f Environmental → Air → Unknown EF 3.1 kg 2
007e90ae-7846-4748-820c-e3079859d7f2 Environmental → Ground → Agricultural EF 3.1 kg 2
a8b3a8b4-7915-4ce2-ade9-fd16e26c2054 Environmental → Ground → Non-agricultural EF 3.1 kg 2
ceb2d822-307c-488e-8ff6-4570b0afd767 Environmental → Ground → Unknown EF 3.1 kg 2
f32b22a3-1b50-4def-a7b6-5f163dffa8c6 Environmental → Water → Long-term EF 3.1 kg 0
09e8fed3-7b08-4468-ac68-c751af786109 Environmental → Water → Ocean EF 3.1 kg 2
516367c4-47a7-4f07-b338-a244b3119b04 Environmental → Water → Surface water EF 3.1 kg 2
0d400d14-81cd-43bf-8852-7fb8537e34fc Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-11bcc768eed96cf1",
  "prefLabel": [
    {
      "@value": "Bis[2-(2-ethoxyethoxy)ethyl] Cyclohexane-1,4-dicarboxylate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "bootstrap_labels",
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        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "1,4-Bis[2-(2-ethoxyethoxy)ethyl] 1,4-cyclohexanedicarboxylate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1,4-Cyclohexanedicarboxylic acid, 1,4-bis[2-(2-ethoxyethoxy)ethyl] ester",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Bis(ethoxydiglycol) cyclohexane-1,4-dicarboxylate",
      "@language": "en",
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      "provenance": {
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      }
    },
    {
      "@value": "Bis(ethoxydiglycol) cyclohexanedicarboxylate",
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}

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