Brightway Flows 1.0
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3-methoxypropan-1-amine

fo-56e4a696daf8d48a

Identity

Type
Neutral molecule
CAS
5332-73-0
EC
226-241-3
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 3-methoxypropan-1-amine

Alternative labels

15

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string FAXDZWQIWUSWJH-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C4H11NO/c1-6-4-2-3-5/h2-5H2,1H3
IUPAC name chemrof:IUPAC_name 3-methoxypropan-1-amine
Molecular formula chemrof:molecular_formula C4H11NO
Molecular mass chemrof:molecular_mass 89.138
Monoisotopic mass chemrof:monoisotopic_mass 89.084064
SMILES string chemrof:smiles_string COCCCN

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=5332-73-0 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.023.856 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID7027596 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=552 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3186458 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/VT819VO82Z enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0245920 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.072D enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/1672 enrich_references.pubchem_compound
Wikidata https://www.wikidata.org/wiki/Q27292011 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
ab5f3bfc-0707-4c97-9a10-0ff2bea09d70 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
9a6be50f-2aa0-4163-a23f-cd56f89c80de Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
0c547976-bbae-4a6b-82c0-e5b33e006216 Environmental → Air → Indoor EF 3.1 kg 4
bfad6d16-0832-4066-b5f2-03a9ef8a12de Environmental → Air → Long-term EF 3.1 kg 0
4e93d5c0-e85d-4bce-84c3-5ffc0e270675 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
2a41ed06-bbfb-43a9-ab5a-e9a56009ca92 Environmental → Air → Unknown EF 3.1 kg 4
3a577c79-31ac-4ee4-9471-0bd96fb489ea Environmental → Ground → Agricultural EF 3.1 kg 4
9c1df129-476d-41e6-92cd-4846862b0476 Environmental → Ground → Non-agricultural EF 3.1 kg 4
72c254da-dd16-4b4f-a61e-7a3d383cc572 Environmental → Ground → Unknown EF 3.1 kg 4
deaa86b9-03ac-4ee3-ba83-6d54dccb5a38 Environmental → Water → Long-term EF 3.1 kg 0
5f9e910b-954f-493f-aeb4-0daf24a467a5 Environmental → Water → Ocean EF 3.1 kg 4
c811d0dc-c430-4bda-82e6-5225e484ff5c Environmental → Water → Surface water EF 3.1 kg 4
55309c70-111b-4439-ac8e-f5453f373063 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 
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        "https://commonchemistry.cas.org/detail?cas_rn=5332-73-0"
      ],
      "http://www.w3.org/2004/02/skos/core#exactMatch": [
        {
          "@id": "https://commonchemistry.cas.org/detail?cas_rn=5332-73-0"
        }
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "brightway-flows",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    "http://semanticscience.org/resource/CHEMINF_000447": {
      "@value": [
        "226-241-3"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=226-241-3"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "brightway-flows",
        "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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You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works

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