Consensus flow list

Identity

Type
Neutral molecule
CAS
628-89-7
EC
211-059-9
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 2-(2-chloroethoxy)ethanol

Alternative labels

11

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string LECMBPWEOVZHKN-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C4H9ClO2/c5-1-3-7-4-2-6/h6H,1-4H2
IUPAC name chemrof:IUPAC_name 2-(2-chloroethoxy)ethanol
Molecular formula chemrof:molecular_formula C4H9ClO2
Molecular mass chemrof:molecular_mass 124.567
Monoisotopic mass chemrof:monoisotopic_mass 124.029107
SMILES string chemrof:smiles_string OCCOCCCl

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=52137-03-8 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=628-89-7 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.010.055 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID9060861 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=2648 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/R2UP818L4I enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J34.792B enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/12361 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27287714 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
e94d13a2-60af-4c46-ae1f-d681b04897db Environmental → Air → Aircraft cruise height EF 3.1 kg 4
d7c517de-17ba-4994-9b5f-83cbd7365fc7 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
0e6f69ac-d2a6-458b-ba2a-da2828c6cdbc Environmental → Air → Indoor EF 3.1 kg 4
2a49c66b-3117-4b08-baa6-2617837d852f Environmental → Air → Long-term EF 3.1 kg 0
48cc92cf-016c-44db-89f4-87be2fda96c0 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
cf912f4d-27d7-46b3-88b2-57929ac1f943 Environmental → Air → Unknown EF 3.1 kg 4
ee7258c6-ecfd-412a-90a1-dce2558ec27c Environmental → Ground → Agricultural EF 3.1 kg 4
38883bd5-198b-484e-8d73-de39e1650953 Environmental → Ground → Non-agricultural EF 3.1 kg 4
e1f1b651-8f58-4072-97b4-d812a833e3a2 Environmental → Ground → Unknown EF 3.1 kg 4
4b2f52b3-4720-4296-bf5e-dfdb1611d74a Environmental → Water → Long-term EF 3.1 kg 0
13a5e139-a744-4a3c-a451-5c5e987aadf1 Environmental → Water → Ocean EF 3.1 kg 4
47860bc0-1571-4322-9f0e-2b5be1758f7a Environmental → Water → Surface water EF 3.1 kg 4
b0babf18-8e63-4a7c-b34d-7797ea5f874d Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-e7bcead56e0c0c0c",
  "prefLabel": [
    {
      "@value": "2-(2-chloroethoxy)ethanol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "bootstrap_labels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "2-(2-Chloroethoxy)ethan-1-ol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=628-89-7"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-(2-Hydroxyethoxy)ethyl chloride",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
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          "https://commonchemistry.cas.org/detail?cas_rn=628-89-7"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-(2′-Chloroethoxy)ethanol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-(Chloroethoxy)ethanol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-[(2-Chloroethyl)oxy]ethanol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Chloroethyl 2-hydroxyethyl ether",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "5-Chloro-3-oxa-1-pentanol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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      }
    },
    {
      "@value": "Diethylene glycol monochlorohydrin",
      "@language": "en",
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        ],
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      }
    },
    {
      "@value": "Diglycol chlorohydrin",
      "@language": "en",
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      "provenance": {
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      }
    },
    {
      "@value": "Ethanol, 2-(2-chloroethoxy)-",
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      }
    },
    {
      "@value": "Ethylene glycol mono(2-chloroethyl) ether",
      "@language": "en",
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    "https://w3id.org/chemrof/inchi2d_key_string": {
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    },
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