Brightway Flows 1.0
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Neburon

fo-f5afa50c8c06b781

Identity

Type
Neutral molecule
CAS
555-37-3
EC
209-096-0
Origin
EF 3.1 hybrid_name_cas_v1
Changes
57 across every transformer

Structure

Structure diagram for Neburon

Alternative labels

12

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string CCGPUGMWYLICGL-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C12H16Cl2N2O/c1-3-4-7-16(2)12(17)15-9-5-6-10(13)11(14)8-9/h5-6,8H,3-4,7H2,1-2H3,(H,15,17)
IUPAC name chemrof:IUPAC_name 1-n-Butyl-3-(3,4-dichlorophenyl)-1-methylurea
Molecular formula chemrof:molecular_formula C12H16Cl2N2O
Molecular mass chemrof:molecular_mass 275.179
Monoisotopic mass chemrof:monoisotopic_mass 274.063968, 274.06397
SMILES string chemrof:smiles_string CCCCN(C)C(=O)Nc1ccc(Cl)c(Cl)c1

Known URLs

13

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=555-37-3 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:7491 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.008.270 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID4042200 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL75410 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/4MXN71654X enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.619E enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C11188 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C11188 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=67615 enrich_references.pubchem_identifier_url
ppdb ppdb:483 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/11145 enrich_references.pubchem_compound
Wikidata https://www.wikidata.org/wiki/Q22808466 enrich_references.pubchem_identifier_url

Elementary flows

14
Flow Context Source Unit CFs
d9b2ab53-ba01-4054-97ea-0b08a4804a91 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
cf60319b-b56d-463a-bc2f-730501e98fc2 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
6885c6b1-f08a-4840-bbf3-cea884b28a1a Environmental → Air → Indoor EF 3.1 kg 2
ad1d6895-5774-4ec9-b2bd-cce95380ebea Environmental → Air → Long-term EF 3.1 kg 0
318220dd-67e3-4552-8dc8-ec2d852ae7b7 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
7915c24c-2557-4e02-abfb-974fddfb15b3 Environmental → Air → Unknown EF 3.1 kg 2
a8cc8860-effb-43e6-b933-12a5dadd52ce Environmental → Ground → Agricultural EF 3.1 kg 2
d1099e22-c413-4ffc-8a5d-670a555bf115 Environmental → Ground → Non-agricultural EF 3.1 kg 2
e253b492a16f768eaf1200d71f831bf6841c048c Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
c049ad6d-29ec-4670-8a6a-2659f886defc Environmental → Ground → Unknown EF 3.1 kg 2
bdc2c6c4-c0ec-4594-9514-a06fc8190416 Environmental → Water → Long-term EF 3.1 kg 0
5c8f4c83-7a80-469a-8d21-38c539092327 Environmental → Water → Ocean EF 3.1 kg 2
d07dc8bf-996c-4ae3-a74f-bbc5e68808cf Environmental → Water → Surface water EF 3.1 kg 2
0b8a243c-64e6-4906-93eb-756666f2b761 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (57 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-f5afa50c8c06b781",
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  "altLabel": [
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}

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You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works

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