Consensus flow list

Identity

Type
Neutral molecule
CAS
122-51-0
EC
204-550-4
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for Triethyl Orthoformate

Alternative labels

12

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string GKASDNZWUGIAMG-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C7H16O3/c1-4-8-7(9-5-2)10-6-3/h7H,4-6H2,1-3H3
IUPAC name chemrof:IUPAC_name Triethyl Orthoformate
Molecular formula chemrof:molecular_formula C7H16O3
Molecular mass chemrof:molecular_mass 148.202
Monoisotopic mass chemrof:monoisotopic_mass 148.109944
SMILES string chemrof:smiles_string CCOC(OCC)OCC

Known URLs

13

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=122-51-0 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.004.138 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID8041957 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=5289 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1476236 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/355LRR361Q enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0259190 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J5.533F enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=123528 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/31214 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#2524 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q421330 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Triethyl_orthoformate enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
84d89300-327c-4f79-aef6-05c58cbb7aff Environmental → Air → Aircraft cruise height EF 3.1 kg 2
bc951b24-8084-40ef-acaf-7bccd4da3782 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
abf9ec97-e3f1-4dfa-8222-e4510f4ad1b6 Environmental → Air → Indoor EF 3.1 kg 2
3fb05b80-cbd0-4fbf-b05d-f032a6e4b2a1 Environmental → Air → Long-term EF 3.1 kg 0
7115bb71-1fc6-46f6-b3de-cd890b9e26c7 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
56453320-4ab9-4f3e-a649-a34c3b4ed3e5 Environmental → Air → Unknown EF 3.1 kg 2
8d21a2c0-3b16-4745-bc5c-e083f2721938 Environmental → Ground → Agricultural EF 3.1 kg 2
b3d437f5-7966-44f3-8bc2-18d001555405 Environmental → Ground → Non-agricultural EF 3.1 kg 2
d1ef3534-9620-4892-b385-ef5b3c94da43 Environmental → Ground → Unknown EF 3.1 kg 2
090ebef4-c8f6-48c8-92f3-e68cc1ed6e47 Environmental → Water → Long-term EF 3.1 kg 0
17d3d845-0281-41ae-947f-08db4fd164f0 Environmental → Water → Ocean EF 3.1 kg 2
8c00b632-7624-41d0-b78b-a5c1c237c4f4 Environmental → Water → Surface water EF 3.1 kg 2
9268e7cc-4991-4da2-ad2e-f98d682116b3 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
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      "rdfs:seeAlso": [
        "https://commonchemistry.cas.org/detail?cas_rn=122-51-0"
      ],
      "http://www.w3.org/2004/02/skos/core#exactMatch": [
        {
          "@id": "https://commonchemistry.cas.org/detail?cas_rn=122-51-0"
        }
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    "http://semanticscience.org/resource/CHEMINF_000447": {
      "@value": [
        "204-550-4"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=204-550-4"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "ec_numbers"
      }
    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ]
}

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