Consensus flow list

Identity

Type
Neutral molecule
CAS
110-85-0
EC
203-808-3
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Piperazine

Alternative labels

21

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string GLUUGHFHXGJENI-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C4H10N2/c1-2-6-4-3-5-1/h5-6H,1-4H2
IUPAC name chemrof:IUPAC_name Piperazine
Molecular formula chemrof:molecular_formula C4H10N2
Molecular mass chemrof:molecular_mass 86.138
Monoisotopic mass chemrof:monoisotopic_mass 86.084398, 86.0844
SMILES string chemrof:smiles_string C1CNCCN1

Known URLs

49

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=110-85-0 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=31977-51-2 enrich_references.pubchem_identifier_url
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:28568 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.003.463 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=1032 enrich_references.pubchem_identifier_url
ChemSpider https://www.chemspider.com/Chemical-Structure.13835459.html enrich_references.chebi_xrefs
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID1021164 enrich_references.pubchem_identifier_url
DrugBank https://go.drugbank.com/drugs/DB00592 enrich_references.chebi_xrefs
drugbank.ca https://www.drugbank.ca/drugs/DB00592 enrich_references.pubchem_identifier_url
drugcentral drugcentral:2188 enrich_references.chebi_xrefs
drugcentral.org https://drugcentral.org/drugcard/2188 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=474 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=757283 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1412 enrich_references.pubchem_identifier_url
femaflavor.org https://www.femaflavor.org/flavor-library/piperazine enrich_references.pubchem_identifier_url
foodb.food foodb.food:FDB012189 enrich_references.chebi_xrefs
gmelin gmelin:25695 enrich_references.chebi_xrefs
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/1RTM4PAL0V enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0014730 enrich_references.chebi_xrefs
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.981J enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C07973 enrich_references.chebi_xrefs
KEGG https://www.genome.jp/entry/D00807 enrich_references.chebi_xrefs
KEGG https://www.genome.jp/entry/D02145 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C07973 enrich_references.pubchem_identifier_url
kegg.jp https://www.kegg.jp/entry/D00807 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=42923 enrich_references.pubchem_identifier_url
MetaCyc https://metacyc.org/compound?orgid=META&id=PIPERAZINE enrich_references.chebi_xrefs
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C61892 enrich_references.pubchem_identifier_url
pdb-ccd pdb-ccd:PZE enrich_references.chebi_xrefs
pesticides pesticides:piperazine enrich_references.chebi_xrefs
pharmgkb.org https://www.pharmgkb.org/chemical/PA450977 enrich_references.pubchem_identifier_url
platform.opentargets.org https://platform.opentargets.org/drug/CHEMBL1412 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/4837 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#2579 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=037715 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/15017096 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/16987490 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24201896 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/28842264 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/29438107 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/32912125 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/33336346 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/33751807 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/9265850 enrich_references.chebi_xrefs
reaxys reaxys:102555 enrich_references.chebi_xrefs
rxnav.nlm.nih.gov https://rxnav.nlm.nih.gov/id/rxnorm/8340 enrich_references.pubchem_identifier_url
vsdb vsdb:1781 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q409292 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Piperazine enrich_references.chebi_xrefs

Elementary flows

13
Flow Context Source Unit CFs
df3299b7-da6a-47db-ae08-fec204a369c2 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
1fbda052-58aa-4f43-b98a-0db6d8e3e264 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
00eeb15b-8497-4646-9f64-f8ca8ada227c Environmental → Air → Indoor EF 3.1 kg 4
b68f6ed7-bf5d-41d2-9144-1d7180feaf05 Environmental → Air → Long-term EF 3.1 kg 0
813cd0d3-2c92-419c-92fc-29646e2c0cd0 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
87779893-38fd-404c-a6c8-d95661f3cb03 Environmental → Air → Unknown EF 3.1 kg 4
ff8f0ead-3af8-4998-a2c4-507f4adfcd03 Environmental → Ground → Agricultural EF 3.1 kg 4
d167df12-c8ef-4c6d-8d0a-b449cc7b5560 Environmental → Ground → Non-agricultural EF 3.1 kg 4
2bc70682-7ae7-43cf-974e-79a9228171d6 Environmental → Ground → Unknown EF 3.1 kg 4
c5d4fee3-0b14-4f46-912f-e219b357e431 Environmental → Water → Long-term EF 3.1 kg 0
c2703438-1bf9-4a26-a5c7-be2933c47dcc Environmental → Water → Ocean EF 3.1 kg 4
0e0114c2-b4e6-495e-bbad-79a862e91207 Environmental → Water → Surface water EF 3.1 kg 4
4ab585fc-124d-47aa-9af1-451424eef9d5 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-8f391efa95e30faf",
  "prefLabel": [
    {
      "@value": "Piperazine",
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    {
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    {
      "@value": "hexahydro-1,4-diazine",
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        "prov:wasDerivedFrom": "chebi synonym match"
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    },
    {
      "@value": "Hexahydropyrazine",
      "@language": "en",
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    },
    {
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    },
    {
      "@value": "Piperazidine",
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    },
    {
      "@value": "Pipersol",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
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    },
    {
      "@value": "Pyrazine hexahydride",
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    {
      "@value": "Pyrazine, hexahydro-",
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    },
    {
      "@value": "Tetrahydro-1,4-diazine",
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    },
    {
      "@value": "Uvilon",
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        ],
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      }
    },
    {
      "@value": "Vermex",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Vermizine (TN)",
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    },
    {
      "@value": "Worm-A-Ton",
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    },
    {
      "@value": "Wurmirazin",
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        ],
        "prov:wasDerivedFrom": "chebi.xrefs_urls"
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    "seed_uuid": "00eeb15b-8497-4646-9f64-f8ca8ada227c",
    "seed_source": "EF 3.1",
    "semantic_typing": {
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        "110-85-0"
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      "rdfs:seeAlso": [
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      ],
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    },
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        "203-808-3"
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        ],
        "prov:wasDerivedFrom": "ec_numbers"
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    }
  },
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  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "http://www.w3.org/2004/02/skos/core#definition": [
    {
      "@value": "An azacycloalkane that consists of a six-membered ring containing two nitrogen atoms at opposite positions.",
      "@language": "en",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.chebi_definition",
        "prov:wasAttributedTo": "consensus-flow-list",
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          "http://purl.obolibrary.org/obo/CHEBI_28568"
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      }
    }
  ],
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ]
}

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