Consensus flow list

Identity

Type
Neutral molecule
CAS
115-46-8
EC
204-092-5
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Diphenyl(piperidin-4-yl)methanol

Alternative labels

13

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string ZMISODWVFHHWNR-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C18H21NO/c20-18(15-7-3-1-4-8-15,16-9-5-2-6-10-16)17-11-13-19-14-12-17/h1-10,17,19-20H,11-14H2
IUPAC name chemrof:IUPAC_name Diphenyl(piperidin-4-yl)methanol
Molecular formula chemrof:molecular_formula C18H21NO
Molecular mass chemrof:molecular_mass 267.372
Monoisotopic mass chemrof:monoisotopic_mass 267.16231, 267.162314
SMILES string chemrof:smiles_string OC(c1ccccc1)(c1ccccc1)C1CCNCC1

Known URLs

16

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=115-46-8 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:93706 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.003.720 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID2045280 enrich_references.pubchem_identifier_url
drugbank.ca https://www.drugbank.ca/drugs/DB19381 enrich_references.pubchem_identifier_url
drugcentral drugcentral:3680 enrich_references.chebi_xrefs
drugcentral.org https://drugcentral.org/drugcard/3680 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL127508 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/2MMR990PEM enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0248759 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J5.268J enrich_references.pubchem_identifier_url
lincs.smallmolecule lincs.smallmolecule:LSM-4191 enrich_references.chebi_xrefs
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C76502 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/15723 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q4832014 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Azacyclonol enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
bf655d43-5da5-4e90-b59e-11587c556f71 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
59c77e67-2ff5-45bc-b5b2-b906ae8f57c7 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
72f2a395-fe60-4c68-975c-36e1a2eb7d18 Environmental → Air → Indoor EF 3.1 kg 2
cea94f3e-45a1-4d01-9226-edbe2fa94603 Environmental → Air → Long-term EF 3.1 kg 0
9e0b8577-5c54-4bc4-9e46-ceaa66c350c8 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
2d62e3e9-72d6-450b-8df0-bcb056652486 Environmental → Air → Unknown EF 3.1 kg 2
8f14682a-3fe7-4a76-b029-4c2a5c27a468 Environmental → Ground → Agricultural EF 3.1 kg 2
3bd32202-2160-46a0-a30d-fc19a870e771 Environmental → Ground → Non-agricultural EF 3.1 kg 2
8eb74073-432d-412e-a92d-fa250b798edf Environmental → Ground → Unknown EF 3.1 kg 2
83df80ad-524d-46fb-976b-a3ab88993264 Environmental → Water → Long-term EF 3.1 kg 0
58b06833-5d1c-4156-83e9-dcdef57c7313 Environmental → Water → Ocean EF 3.1 kg 2
28226f5e-4846-43b7-8e4e-1604c7524769 Environmental → Water → Surface water EF 3.1 kg 2
ad6de6a9-e09d-40ce-9b32-1c378005fe5e Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON
{
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        "prov:wasDerivedFrom": "legacy name field"
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    }
  ],
  "altLabel": [
    {
      "@value": "4-(Diphenylhydroxymethyl)piperidine",
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      "@lang": "en",
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        ],
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      }
    },
    {
      "@value": "4-(Hydroxydiphenylmethyl)piperidine",
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    },
    {
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