Consensus flow list

Identity

Type
NeutralMolecule
CAS
34681-23-7
EC
252-140-9
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for Butoxycarboxim

What it is used for

3

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
insecticide CHEBI:24852 Strictly, a substance intended to kill members of the class Insecta. In common usage, any substance used for preventing, destroying, repelling or controlling insects. 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

8

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string CTJBHIROCMPUKL-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C7H14N2O4S/c1-5(6(2)14(4,11)12)9-13-7(10)8-3/h6H,1-4H3,(H,8,10)
IUPAC name chemrof:IUPAC_name 3-(Methylsulfonyl)-2-butanone O-((methylamino)carbonyl)oxime
Molecular formula chemrof:molecular_formula C7H14N2O4S
Molecular mass chemrof:molecular_mass 222.266
Monoisotopic mass chemrof:monoisotopic_mass 222.067428, 222.06743
SMILES string chemrof:smiles_string CNC(=O)ON=C(C)C(C)S(C)(=O)=O

Known URLs

4

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=34681-23-7 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:38470 enrich_references.chebi_id_link
KEGG https://www.genome.jp/entry/C18646 enrich_references.chebi_xrefs
ppdb ppdb:103 enrich_references.chebi_xrefs

Elementary flows

14
Flow Context Source Unit CFs
ce77d638-6be7-4adc-b44b-a21bb67774de Environmental → Air → Aircraft cruise height EF 3.1 kg 2
8f372f89-8441-496b-9f31-5ac6d948c10f Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
e4251424-1637-4adf-b6df-1cf7546dba65 Environmental → Air → Indoor EF 3.1 kg 2
09065141-98e4-4538-a8b0-ee07c2fd7a24 Environmental → Air → Long-term EF 3.1 kg 0
74cbb292-ef88-4582-8283-9bf488f650c8 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
fa868ccf-3502-49a0-a445-23ae766e8956 Environmental → Air → Unknown EF 3.1 kg 2
e0d6a05e-3c3a-4cb8-af16-94c5ce943b86 Environmental → Ground → Agricultural EF 3.1 kg 2
6043fd04-4d23-4e87-881f-014c229d94ad Environmental → Ground → Non-agricultural EF 3.1 kg 2
27d5e76b49f88d421b479db60c017a71bf1480c8 Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
0009a787-4fe4-48ad-ad29-cc9735fa5a3d Environmental → Ground → Unknown EF 3.1 kg 2
bf799c33-2036-43e7-9463-937322c5dbb9 Environmental → Water → Long-term EF 3.1 kg 0
eedb846c-186e-41f6-9518-f5162bd9825e Environmental → Water → Ocean EF 3.1 kg 2
952327a6-e30d-4ff9-bd89-46f12bd9b6ae Environmental → Water → Surface water EF 3.1 kg 2
c894a15b-96cf-45a8-bbd6-329f5cf21d3d 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-9f1a7ca5aa1aebb3",
  "prefLabel": [
    {
      "@value": "Butoxycarboxim",
      "@language": "en",
      "@lang": "en",
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        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "(3-Methanesulfonylbutan-2-ylidene)amino N-methylcarbamate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=34681-23-7"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Butanone, 3-(methylsulfonyl)-, O-[(methylamino)carbonyl]oxime",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "3-(Methylsulfonyl)-2-butanone O-((methylamino)carbonyl)oxime",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "http://purl.obolibrary.org/obo/CHEBI_38470"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "3-(Methylsulfonyl)-2-butanone O-(methylcarbamoyl)oxime",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
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    },
    {
      "@value": "3-Mesylbutanone O-methylcarbamoyloxime",
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
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    },
    {
      "@value": "Butocarboxim sulfone",
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      "provenance": {
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    },
    {
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      }
    },
    {
      "@value": "N-(methylcarbamoyloxy)-3-(methanesulfonyl)butan-2-imine",
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}

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