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Secbumeton

fo-d1a4b75ac8d4608b

Identity

Type
Neutral molecule
CAS
26259-45-0
EC
247-554-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for Secbumeton

What it is used for

4

Roles, not types. A substance bears as many as apply — sulfluramid is an insecticide and an acaricide — and each is a class ChEBI curates, asserted with ChEBI’s own has role. The narrow ones publish the broad ones alongside them, so a substance filed as a herbicide is a pesticide here too. See agricultural chemicals for what the axis is and which classes are published.

Role Definition Evidence
agrochemical CHEBI:33286 An agrochemical is a substance that is used in agriculture or horticulture. ChEBI
environmental contaminant CHEBI:78298 Any minor or unwanted substance introduced into the environment that can have undesired effects. ChEBI
herbicide CHEBI:24527 A substance used to destroy plant pests. ChEBI
pesticide CHEBI:25944 Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests. ChEBI

Alternative labels

21

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string ZJMZZNVGNSWOOM-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C10H19N5O/c1-5-7(3)12-9-13-8(11-6-2)14-10(15-9)16-4/h7H,5-6H2,1-4H3,(H2,11,12,13,14,15)
IUPAC name chemrof:IUPAC_name (RS)-N(2)-sec-butyl-N(4)-ethyl-6-methoxy-1,3,5-triazine-2,4-diamine
Molecular formula chemrof:molecular_formula C10H19N5O
Molecular mass chemrof:molecular_mass 225.296
Monoisotopic mass chemrof:monoisotopic_mass 225.15896
SMILES string chemrof:smiles_string CCNc1nc(NC(C)CC)nc(OC)n1

Known URLs

22

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
agr agr:IND44654545 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=26259-45-0 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:82228 enrich_references.chebi_id_link
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:83786 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.043.216 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID8037594 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1894841 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/EG062W4WWU enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J20.114F enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C19106 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C19106 enrich_references.pubchem_identifier_url
patent patent:CA2518621 enrich_references.chebi_xrefs
patent patent:KR20050115906 enrich_references.chebi_xrefs
patent patent:US2006154823 enrich_references.chebi_xrefs
patent patent:US2014309111 enrich_references.chebi_xrefs
pesticides pesticides:secbumeton enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/33443 enrich_references.pubchem_compound
PubMed https://pubmed.ncbi.nlm.nih.gov/16916034 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24607694 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24720960 enrich_references.chebi_xrefs
reaxys reaxys:8981797 enrich_references.chebi_xrefs
Wikidata https://www.wikidata.org/wiki/Q27157217 enrich_references.pubchem_identifier_url

Elementary flows

14
Flow Context Source Unit CFs
8cab4738-f3b0-4a32-98a1-a7a3c8076b8d Environmental → Air → Aircraft cruise height EF 3.1 kg 2
95b58711-87af-4f07-9008-eb039ea3754d Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
8c7b8aba-d202-4725-b427-cfb25b450f53 Environmental → Air → Indoor EF 3.1 kg 2
37bb5b0b-984b-4d25-8c0b-c186faf6aace Environmental → Air → Long-term EF 3.1 kg 0
911f4d26-8fd2-44cd-9b16-5e0a240a79f3 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
a6f65dce-dda6-43ec-b361-580d3e64dbbe Environmental → Air → Unknown EF 3.1 kg 2
ffe326a6-83a2-4df9-b51a-94d0c1c00d24 Environmental → Ground → Agricultural EF 3.1 kg 2
1aff7b65-d395-43e2-add2-869f697e1c35 Environmental → Ground → Non-agricultural EF 3.1 kg 2
cf985bc95af0d1885026b8cc23594484488b8b39 Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
1fa08191-085a-48d4-98e5-5ce8ff4b34f5 Environmental → Ground → Unknown EF 3.1 kg 2
18e55abf-df53-43fc-99da-65c6ddc91f57 Environmental → Water → Long-term EF 3.1 kg 0
f4430893-711c-44bd-9ed4-7b237556746e Environmental → Water → Ocean EF 3.1 kg 2
67817087-a337-4151-8359-eae3055ab602 Environmental → Water → Surface water EF 3.1 kg 2
1babb68c-7de1-4b34-a1e4-38855ccaba3a Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (58 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-d1a4b75ac8d4608b",
  "prefLabel": [
    {
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  "altLabel": [
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    },
    {
      "@value": "1,3,5-Triazine-2,4-diamine, N-ethyl-6-methoxy-N′-(1-methylpropyl)-",
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      "@value": "1,3,5-Triazine-2,4-diamine, N2-ethyl-6-methoxy-N4-(1-methylpropyl)-",
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    },
    {
      "@value": "2-(sec-butylamino)-4-(ethylamino)-6-methoxy-s-triazine",
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      }
    },
    {
      "@value": "2-(sec-Butylamino)-4-ethylamino-6-methoxy-s-triazine",
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    },
    {
      "@value": "2-Methoxy-4-ethylamino-6-sec-butylamino-1,3,5-triazine",
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    },
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      "@value": "2-Methoxy-4-ethylamino-6-sec-butylamino-s-triazine",
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    },
    {
      "@value": "2-N-(Butan-2-yl)-4-N-ethyl-6-methoxy-1,3,5-triazine-2,4-diamine",
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      "@value": "Etazin",
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    },
    {
      "@value": "Etazine",
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    },
    {
      "@value": "Ezitan",
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    },
    {
      "@value": "Geigy GS 14254",
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    },
    {
      "@value": "N-ethyl-6-methoxy-N'-(1-methylpropyl)-1,3,5-triazine-2,4-diamine",
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    },
    {
      "@value": "N2-Ethyl-6-methoxy-N4-(1-methylpropyl)-1,3,5-triazine-2,4-diamine",
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        ],
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    },
    {
      "@value": "rac-N-(butan-2-yl)-N'-ethyl-6-methoxy-1,3,5-triazine-2,4-diamine",
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      "provenance": {
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    },
    {
      "@value": "s-Triazine, 2-(sec-butylamino)-4-(ethylamino)-6-methoxy-",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "sec-Bumeton",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
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      }
    },
    {
      "@value": "sec-bumetone",
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      }
    },
    {
      "@value": "secumbeton",
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      "@lang": "en",
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          "http://purl.obolibrary.org/obo/CHEBI_82228"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Sumitol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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          "https://commonchemistry.cas.org/detail?cas_rn=26259-45-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Sumitol 80W",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
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  ],
  "properties": {
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}

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