Consensus flow list

Identity

Type
Neutral molecule
CAS
34014-18-1
EC
251-793-7
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Tebuthiuron

Alternative labels

13

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string HBPDKDSFLXWOAE-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C9H16N4OS/c1-9(2,3)6-11-12-8(15-6)13(5)7(14)10-4/h1-5H3,(H,10,14)
IUPAC name chemrof:IUPAC_name 1,3-Dimethyl-1-(5-tert-butyl-1,3,4-thiadiazol-2-yl)urea
Molecular formula chemrof:molecular_formula C9H16N4OS
Molecular mass chemrof:molecular_mass 228.321
Monoisotopic mass chemrof:monoisotopic_mass 228.10448, 228.104482
SMILES string chemrof:smiles_string CNC(=O)N(C)c1nnc(C(C)(C)C)s1

Known URLs

15

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=34014-18-1 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:81745 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.047.070 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID3024316 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1457493 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/E5OX6GM11E enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J21.702F enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C18436 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C18436 enrich_references.pubchem_identifier_url
lincs.smallmolecule lincs.smallmolecule:LSM-2761 enrich_references.chebi_xrefs
ppdb ppdb:614 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/5383 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#3077 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q125986 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Tebuthiuron enrich_references.pubchem_identifier_url

Elementary flows

15
Flow Context Source Unit CFs
3e4d296c-6556-11dd-ad8b-0800200c9a66 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
fe0acd60-3ddc-11dd-a236-0050c2490048 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
48fca8af-5e02-4d73-8b09-7660d441bc0e Environmental → Air → Indoor EF 3.1 kg 4
fe0acd60-3ddc-11dd-a235-0050c2490048 Environmental → Air → Long-term EF 3.1 kg 0
fe0acd60-3ddc-11dd-a237-0050c2490048 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
fe0acd60-3ddc-11dd-a234-0050c2490048 Environmental → Air → Unknown EF 3.1 kg 4
fe0acd60-3ddc-11dd-a232-0050c2490048 Environmental → Ground → Agricultural EF 3.1 kg 4
08a91e70-3ddc-11dd-9103-0050c2490048 Environmental → Ground → Non-agricultural EF 3.1 kg 4
ce84b35df9576a6fe2dff68b63ca8f4614f9570c Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
fe0acd60-3ddc-11dd-a233-0050c2490048 Environmental → Ground → Unknown EF 3.1 kg 4
fe0acd60-3ddc-11dd-a239-0050c2490048 Environmental → Water → Long-term EF 3.1 kg 0
08a91e70-3ddc-11dd-9104-0050c2490048 Environmental → Water → Ocean EF 3.1 kg 4
fe0acd60-3ddc-11dd-a238-0050c2490048 Environmental → Water → Surface water EF 3.1 kg 4
52e4853cc2415b09a5ddd22331d0caf054f2ff72 Environmental → Water → Unconfined aquifer ecoinvent algorithm addition kg 0
08a91e70-3ddc-11dd-9102-0050c2490048 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-2df24ecf9d0c77b9",
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  "altLabel": [
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    },
    {
      "@value": "1-(5-tert-Butyl-1,3,4-thiadiazol-2-yl)-1,3-dimethylurea",
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      }
    },
    {
      "@value": "Combine",
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    },
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    },
    {
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