Consensus flow list

Haloxyfop

fo-df46ef64d89fd55d

Identity

Type
NeutralMolecule
CAS
69806-34-4
EC
—
Origin
ecoinvent-3.12 hybrid_name_cas_v1
Changes
0 across every transformer

Structure

Structure diagram for Haloxyfop

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
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

6

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string GOCUAJYOYBLQRH-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C15H11ClF3NO4/c1-8(14(21)22)23-10-2-4-11(5-3-10)24-13-12(16)6-9(7-20-13)15(17,18)19/h2-8H,1H3,(H,21,22)
IUPAC name chemrof:IUPAC_name (RS)-2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridyloxy]phenoxy}propionic acid
Molecular formula chemrof:molecular_formula C15H11ClF3NO4
Molecular mass chemrof:molecular_mass 361.701, 361.703
Monoisotopic mass chemrof:monoisotopic_mass 361.03287
SMILES string chemrof:smiles_string CC(Oc1ccc(Oc2ncc(C(F)(F)F)cc2Cl)cc1)C(=O)O

Known URLs

12

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=69806-34-4 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:365 enrich_references.chebi_id_link
KEGG https://www.genome.jp/entry/C04871 enrich_references.chebi_xrefs
pesticides pesticides:haloxyfop enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/22119241 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/23189275 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/25128890 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/2568910 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/25742180 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/25742319 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/28058522 enrich_references.chebi_xrefs
reaxys reaxys:1507817 enrich_references.chebi_xrefs

Elementary flows

7
Flow Context Source Unit CFs
68b94fcb4711dc759b18d8150be3e62672e4387c Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) ecoinvent algorithm addition kg 0
963f9387603f38c5a1b180250d5470dd30f1c68b Environmental → Air → Unknown ecoinvent algorithm addition kg 0
a698a9c92d32b1fc18ba681740855bf77add6667 Environmental → Ground → Agricultural ecoinvent algorithm addition kg 0
565e1183a7bb3a163054d191f42c1a249fed39a7 Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
2fbb9eec76d2db907588cb47d02cb17b4d2498aa Environmental → Ground → Unknown ecoinvent algorithm addition kg 0
4af408934ec1faaf8ecd141d1c83eb6dea94c93b Environmental → Water → Surface water ecoinvent algorithm addition kg 0
b6c8bef8ba2357a6b3fdaf2b555cdd206e06011e Environmental → Water → Unknown ecoinvent algorithm addition kg 0

History

Everything that changed this substance (0 changes)

Open the changes page

Full record

Flow object JSON 
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  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ],
  "http://purl.obolibrary.org/obo/RO_0000087": [
    {
      "@id": "http://purl.obolibrary.org/obo/CHEBI_33286",
      "rdfs:label": "agrochemical",
      "http://www.w3.org/2004/02/skos/core#definition": "An agrochemical is a substance that is used in agriculture or horticulture.",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_roles",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "ChEBI"
        ],
        "prov:wasDerivedFrom": "http://semanticscience.org/resource/CHEMINF_000446 -> ChEBI RO:0000087"
      }
    },
    {
      "@id": "http://purl.obolibrary.org/obo/CHEBI_24527",
      "rdfs:label": "herbicide",
      "http://www.w3.org/2004/02/skos/core#definition": "A substance used to destroy plant pests.",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_roles",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "ChEBI"
        ],
        "prov:wasDerivedFrom": "http://semanticscience.org/resource/CHEMINF_000446 -> ChEBI RO:0000087"
      }
    },
    {
      "@id": "http://purl.obolibrary.org/obo/CHEBI_25944",
      "rdfs:label": "pesticide",
      "http://www.w3.org/2004/02/skos/core#definition": "Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests.",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_roles",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "ChEBI"
        ],
        "prov:wasDerivedFrom": "http://semanticscience.org/resource/CHEMINF_000446 -> ChEBI RO:0000087"
      }
    }
  ]
}

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