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(ethoxymethoxy)cyclododecane

fo-3f9a658fbaf8d96e

Identity

Type
Neutral molecule
CAS
58567-11-6
EC
261-332-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
53 across every transformer

Structure

Structure diagram for (ethoxymethoxy)cyclododecane

Alternative labels

6

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string VQNUNMBDOKEZHS-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C15H30O2/c1-2-16-14-17-15-12-10-8-6-4-3-5-7-9-11-13-15/h15H,2-14H2,1H3
IUPAC name chemrof:IUPAC_name (ethoxymethoxy)cyclododecane
Molecular formula chemrof:molecular_formula C15H30O2
Molecular mass chemrof:molecular_mass 242.403
Monoisotopic mass chemrof:monoisotopic_mass 242.22458
SMILES string chemrof:smiles_string CCOCOC1CCCCCCCCCCC1

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=58567-11-6 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.055.738 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID1052248 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3730724 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J296.979C enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/94111 enrich_references.pubchem_compound
Wikidata https://www.wikidata.org/wiki/Q81984975 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
313f9ba8-7c50-4785-873d-efbfd1382842 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
af89fc62-48a4-4f83-848d-385fb86a1edf Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
2656a60e-ab31-4f0c-961d-76f18eadcc33 Environmental → Air → Indoor EF 3.1 kg 4
8db6c7a4-8393-4fe8-bc60-6bd78dd11624 Environmental → Air → Long-term EF 3.1 kg 0
d071ec23-09b7-4296-a886-ff1c5ed4312f Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
871fcca4-35bc-47ac-b81c-6f8bfd9629ff Environmental → Air → Unknown EF 3.1 kg 4
ad8782c3-eb18-485b-bea6-01c2d748310b Environmental → Ground → Agricultural EF 3.1 kg 4
8fdb3a69-c0ee-4ca9-a6f6-23972759360d Environmental → Ground → Non-agricultural EF 3.1 kg 4
5a032676-5891-4912-9f25-5abd654820eb Environmental → Ground → Unknown EF 3.1 kg 4
3649bf93-0e14-4447-aba1-102fff8264e9 Environmental → Water → Long-term EF 3.1 kg 0
32e07347-7004-485e-b572-9e3c6a7c832c Environmental → Water → Ocean EF 3.1 kg 4
1ca47e4a-4427-41bf-9157-56232b6e1257 Environmental → Water → Surface water EF 3.1 kg 4
47ff662a-27ca-4745-ba51-ce99e1b51fc0 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-3f9a658fbaf8d96e",
  "prefLabel": [
    {
      "@value": "(ethoxymethoxy)cyclododecane",
      "@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": "Amberwood F",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58567-11-6",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58567-11-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Boisambrene forte",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58567-11-6",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58567-11-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Buazambren",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58567-11-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Cyclododecane, (ethoxymethoxy)-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "https://commonchemistry.cas.org/detail?cas_rn=58567-11-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Ethoxymethyl cyclododecyl ether",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Formaldehyde cyclododecyl ethyl acetal",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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      }
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  "properties": {
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    },
    "https://w3id.org/chemrof/smiles_string": {
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      "rdfs:label": "SMILES",
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      ],
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          ]
        },
        {
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    },
    "https://w3id.org/chemrof/inchi2d_string": {
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      "rdfs:label": "InChI",
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      "provenance": [
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        ]
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
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      "rdfs:label": "IUPAC name",
      "@value": [
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      ],
      "provenance": {
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        ]
      },
      "attested_by": {
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        ]
      }
    },
    "https://w3id.org/chemrof/molecular_mass": {
      "@id": "https://w3id.org/chemrof/molecular_mass",
      "rdfs:label": "Molecular mass",
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      ],
      "attested_by": {
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      },
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
      "@id": "https://w3id.org/chemrof/monoisotopic_mass",
      "rdfs:label": "Monoisotopic mass",
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      ],
      "attested_by": {
        "242.22458": [
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        ]
      },
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    }
  },
  "references": [
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      }
    },
    {
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    },
    {
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      "provenance": {
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        "prov:wasDerivedFrom": "pubchem.by_cas[58567-11-6]"
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    {
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    },
    {
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        "prov:wasDerivedFrom": "pubchem.identifiers[58567-11-6]"
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  ],
  "created_from": {
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    "seed_uuid": "1ca47e4a-4427-41bf-9157-56232b6e1257",
    "seed_source": "EF 3.1",
    "semantic_typing": {
      "rule": "neutral_molecule",
      "reason": "",
      "types": [
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      ],
      "provenance": {
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  },
  "classifications": {
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      "rdfs:seeAlso": [
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        "prov:wasDerivedFrom": "ec_numbers"
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  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ]
}

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