Consensus flow list

Identity

Type
NeutralMolecule
CAS
16510-27-3
EC
444-110-0
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 1-cyclopropylmethyl-4-methoxybenzene

Alternative labels

5

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string SHLSJFDJYSSUIP-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C11H14O/c1-12-11-6-4-10(5-7-11)8-9-2-3-9/h4-7,9H,2-3,8H2,1H3
IUPAC name chemrof:IUPAC_name 1-cyclopropylmethyl-4-methoxybenzene
Molecular formula chemrof:molecular_formula C11H14O
Molecular mass chemrof:molecular_mass 162.232
Monoisotopic mass chemrof:monoisotopic_mass 162.104465
SMILES string chemrof:smiles_string COc1ccc(CC2CC2)cc1

Known URLs

10

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=16510-27-3 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.103.938 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.166.697 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID1051773 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL176683 enrich_references.pubchem_identifier_url
femaflavor.org https://www.femaflavor.org/flavor-library/1-cyclopropanemethyl-4-methoxybenzene enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/B5O4EJ2WVY enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.781.875E enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/6422476 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q81984816 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
d0eac4d2-a3ea-48db-b904-c3f63a554245 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
fe69e52b-12b0-4fa0-bfb0-b1af563af78d Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
6000a2fc-7d23-45ef-88ad-9ce55f4ff784 Environmental → Air → Indoor EF 3.1 kg 2
f291dce6-0137-4e16-bee2-46d5eda475ab Environmental → Air → Long-term EF 3.1 kg 0
d1f320d7-0f38-4bdb-a41b-d7c2bfa2114b Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
eded1807-8bbc-4b72-a0f1-9d6589c22520 Environmental → Air → Unknown EF 3.1 kg 2
ed6f3d83-597e-436e-b4e2-964d23596c68 Environmental → Ground → Agricultural EF 3.1 kg 2
09f8e09d-3f60-49f6-927c-44a5719e4dd9 Environmental → Ground → Non-agricultural EF 3.1 kg 2
3780f87b-b04e-4ec8-ad79-2006e5146a2b Environmental → Ground → Unknown EF 3.1 kg 2
dcb5592f-5e24-4f0d-a630-8b7a1785e70a Environmental → Water → Long-term EF 3.1 kg 0
6acf7776-9275-43e5-872e-8a01ba8d836d Environmental → Water → Ocean EF 3.1 kg 2
af3450f5-18f1-466b-b6e3-67abb85251c8 Environmental → Water → Surface water EF 3.1 kg 2
0afd3702-caaf-4f6a-b16c-2e29bbdeaf95 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-ca62b38e813afbfb",
  "prefLabel": [
    {
      "@value": "1-cyclopropylmethyl-4-methoxybenzene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "(4-Methoxybenzyl)cyclopropane",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "https://commonchemistry.cas.org/detail?cas_rn=16510-27-3"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1-(Cyclopropylmethyl)-4-methoxybenzene",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Anisole, p-(cyclopropylmethyl)-",
      "@language": "en",
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        ],
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      }
    },
    {
      "@value": "Benzene, 1-(cyclopropylmethyl)-4-methoxy-",
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}

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