Consensus flow list

Identity

Type
Neutral molecule
CAS
4044-65-9
EC
223-741-3
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Bitoscanate

Alternative labels

11

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string OMWQUXGVXQELIX-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C8H4N2S2/c11-5-9-7-1-2-8(4-3-7)10-6-12/h1-4H
IUPAC name chemrof:IUPAC_name 1,4-Diisothiocyanatobenzene
Molecular formula chemrof:molecular_formula C8H4N2S2
Molecular mass chemrof:molecular_mass 192.268
Monoisotopic mass chemrof:monoisotopic_mass 191.98159
SMILES string chemrof:smiles_string S=C=Nc1ccc(N=C=S)cc1

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=4044-65-9 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:134845 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.021.584 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID3046532 enrich_references.pubchem_identifier_url
drugbank.ca https://www.drugbank.ca/drugs/DB20122 enrich_references.pubchem_identifier_url
drugcentral drugcentral:3033 enrich_references.chebi_xrefs
drugcentral.org https://drugcentral.org/drugcard/3033 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=758884 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL2104676 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/6D1R3P86GX enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J8.674F enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C72149 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/19958 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#2928 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q4918921 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Bitoscanate enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
bd94789a-0e36-40b5-92ec-6f8e635aec18 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
8fb46a8d-74a8-48da-a5ce-5071a2d34e7d Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
a109a5fb-d0de-48ad-ae76-9375a3d03ebc Environmental → Air → Indoor EF 3.1 kg 2
75e66bbd-ed55-48af-a2de-c26cd0a34380 Environmental → Air → Long-term EF 3.1 kg 0
f53b8b20-3f0c-4506-8f25-b84ebf3b24d4 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
121debe8-e7f4-4ceb-9850-0b4956158d3b Environmental → Air → Unknown EF 3.1 kg 2
d50d04cb-67e1-43a4-bd69-f283007b409e Environmental → Ground → Agricultural EF 3.1 kg 2
dc08ddd1-352f-4384-a171-b1ca9f288ba0 Environmental → Ground → Non-agricultural EF 3.1 kg 2
3ece44f4-717a-4502-aff2-04f26e870045 Environmental → Ground → Unknown EF 3.1 kg 2
75de8191-1363-47b9-8bb3-75c3a5a064e7 Environmental → Water → Long-term EF 3.1 kg 0
1034182b-7577-49a3-9c2f-f98ade0ba0e8 Environmental → Water → Ocean EF 3.1 kg 2
d1ca2cab-a1b6-4161-8c18-c5160793809d Environmental → Water → Surface water EF 3.1 kg 2
446942cf-7116-4b6b-a880-240025082112 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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