Consensus flow list

Identity

Type
NeutralMolecule
CAS
21725-46-2
EC
244-544-9
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for Cyanazine

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
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

18

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string MZZBPDKVEFVLFF-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C9H13ClN6/c1-4-12-7-13-6(10)14-8(15-7)16-9(2,3)5-11/h4H2,1-3H3,(H2,12,13,14,15,16)
IUPAC name chemrof:IUPAC_name 2-([4-chloro-6-(ethylamino)-1,3,5-triazin-2-yl]amino)-2-methylpropanenitrile
Molecular formula chemrof:molecular_formula C9H13ClN6
Molecular mass chemrof:molecular_mass 240.698
Monoisotopic mass chemrof:monoisotopic_mass 240.08902, 240.089022
SMILES string chemrof:smiles_string CCNc1nc(Cl)nc(NC(C)(C)C#N)n1

Known URLs

26

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
beilstein beilstein:615509 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=21725-46-2 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:38069 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.040.480 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0391 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID1023990 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1884229 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/W34C4P18WD enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0250604 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.465G enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C14299 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C14299 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=52209 enrich_references.pubchem_identifier_url
pesticides pesticides:cyanazine enrich_references.chebi_xrefs
ppdb ppdb:185 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/30773 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#2763 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#2811 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/16882534 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/23762632 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24607126 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24631619 enrich_references.chebi_xrefs
reaxys reaxys:615509 enrich_references.chebi_xrefs
umbbd.compound umbbd.compound:c0176 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q424848 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Cyanazine enrich_references.pubchem_identifier_url

Elementary flows

14
Flow Context Source Unit CFs
3e4cb452-6556-11dd-ad8b-0800200c9a66 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
fe0acd60-3ddc-11dd-a7d1-0050c2490048 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
9f2347eb-63a9-4741-9547-d14a251ddaee Environmental → Air → Indoor EF 3.1 kg 4
4d9a8790-3ddd-11dd-9897-0050c2490048 Environmental → Air → Long-term EF 3.1 kg 0
fe0acd60-3ddc-11dd-a7d2-0050c2490048 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
4d9a8790-3ddd-11dd-9896-0050c2490048 Environmental → Air → Unknown EF 3.1 kg 4
4d9a8790-3ddd-11dd-9894-0050c2490048 Environmental → Ground → Agricultural EF 3.1 kg 4
fe0acd60-3ddc-11dd-a7d6-0050c2490048 Environmental → Ground → Non-agricultural EF 3.1 kg 4
28c4d6ff767353ffccb670f376d3d07b61faa167 Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
4d9a8790-3ddd-11dd-9895-0050c2490048 Environmental → Ground → Unknown EF 3.1 kg 4
fe0acd60-3ddc-11dd-a7d4-0050c2490048 Environmental → Water → Long-term EF 3.1 kg 0
fe0acd60-3ddc-11dd-a7d7-0050c2490048 Environmental → Water → Ocean EF 3.1 kg 4
fe0acd60-3ddc-11dd-a7d3-0050c2490048 Environmental → Water → Surface water EF 3.1 kg 4
fe0acd60-3ddc-11dd-a7d5-0050c2490048 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (58 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-932aaaac80f693fc",
  "prefLabel": [
    {
      "@value": "Cyanazine",
      "@language": "en",
      "@lang": "en",
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        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "2-(4-Chloro-6-ethylamino-s-triazin-2-ylamino)-2-methylpropionitrile",
      "@language": "en",
      "@lang": "en",
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      }
    },
    {
      "@value": "2-([4-chloro-6-(ethylamino)-1,3,5-triazin-2-yl]amino)-2-methylpropanenitrile",
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    },
    {
      "@value": "2-[[4-Chloro-6-(ethylamino)-1,3,5-triazin-2-yl]amino]-2-methylpropanenitrile",
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      }
    },
    {
      "@value": "2-[[4-Chloro-6-(ethylamino)-1,3,5-triazin-2-yl]amino]-2-methylpropionitrile",
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    },
    {
      "@value": "2-[[4-chloro-6-(ethylamino)-s-triazin-2-yl]amino]-2-methylpropionitrile",
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    },
    {
      "@value": "2-Chloro-4-(1-cyano-1-methylethylamino)-6-ethylamine-1,3,5-triazine",
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    },
    {
      "@value": "2-chloro-4-(1-cyano-1-methylethylamino)-6-ethylamino-1,3,5-triazine",
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "2-Chloro-4-ethylamino-6-(1-methyl-1-cyanoethylamino)-s-triazine",
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      "@lang": "en",
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      }
    },
    {
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    },
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    },
    {
      "@value": "Bladex",
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    },
    {
      "@value": "Bladex 50WP",
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    },
    {
      "@value": "Bladex 80WP",
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      }
    },
    {
      "@value": "Cyanazin",
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    {
      "@value": "Fortrol",
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    },
    {
      "@value": "Gramex",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Propanenitrile, 2-[[4-chloro-6-(ethylamino)-1,3,5-triazin-2-yl]amino]-2-methyl-",
      "@language": "en",
      "@lang": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Propionitrile, 2-[[4-chloro-6-(ethylamino)-s-triazin-2-yl]amino]-2-methyl-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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  "properties": {
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      "@value": [
        "C9H13ClN6"
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