Consensus flow list

Identity

Type
Neutral molecule
CAS
17796-82-6
EC
241-774-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for N-(cyclohexylthio)phthalimide

Alternative labels

21

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string UEZWYKZHXASYJN-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C14H15NO2S/c16-13-11-8-4-5-9-12(11)14(17)15(13)18-10-6-2-1-3-7-10/h4-5,8-10H,1-3,6-7H2
IUPAC name chemrof:IUPAC_name N-(cyclohexylthio)phthalimide
Molecular formula chemrof:molecular_formula C14H15NO2S
Molecular mass chemrof:molecular_mass 261.346
Monoisotopic mass chemrof:monoisotopic_mass 261.08235
SMILES string chemrof:smiles_string O=C1c2ccccc2C(=O)N1SC1CCCCC1

Known URLs

10

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=17796-82-6 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.037.961 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID8027793 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1532794 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/50Z9596NJ3 enrich_references.pubchem_identifier_url
hts.usitc.gov https://hts.usitc.gov/search?query=2930.90.24.00 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J40.152H enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/28777 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q5198723 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Cyclohexylthiophthalimide enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
3f830ed1-a853-4f9b-9dd2-d621805f740c Environmental → Air → Aircraft cruise height EF 3.1 kg 2
9c22c65f-0daa-48dc-8998-7465f14883ac Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
564f3272-8e49-461d-9a5c-0d741b4ce910 Environmental → Air → Indoor EF 3.1 kg 2
bab57be5-489d-4b36-8397-778525bda68d Environmental → Air → Long-term EF 3.1 kg 0
f7cd46fc-009d-45e2-a842-71c0a21ca816 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
6ee1fbda-3192-4bd1-a410-692fbd142a5d Environmental → Air → Unknown EF 3.1 kg 2
3f75344f-60c0-44db-9c6b-1789602394fe Environmental → Ground → Agricultural EF 3.1 kg 2
739fb6b8-e019-417d-9d14-97b84caca77f Environmental → Ground → Non-agricultural EF 3.1 kg 2
717bbc1a-0be5-4a42-9d5f-18804d590c4a Environmental → Ground → Unknown EF 3.1 kg 2
c605b930-a201-4981-a27a-53a05615d7aa Environmental → Water → Long-term EF 3.1 kg 0
58779202-3a03-46fa-a81a-a9d56ee6206c Environmental → Water → Ocean EF 3.1 kg 2
6f1e3873-70e9-4fa9-9331-566bec321d5b Environmental → Water → Surface water EF 3.1 kg 2
10299c65-3ab4-4f2d-89fa-2c290cc67350 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
{
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  "altLabel": [
    {
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