Consensus flow list

Identity

Type
Neutral molecule
CAS
126-99-8
EC
204-818-0
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for Chloroprene

Alternative labels

8

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string YACLQRRMGMJLJV-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C4H5Cl/c1-3-4(2)5/h3H,1-2H2
IUPAC name chemrof:IUPAC_name 2-Chloro-1,3-butadiene
Molecular formula chemrof:molecular_formula C4H5Cl
Molecular mass chemrof:molecular_mass 88.537
Monoisotopic mass chemrof:monoisotopic_mass 88.007978, 88.00798
SMILES string chemrof:smiles_string C=CC(=C)Cl

Known URLs

23

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
beilstein beilstein:741875 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=126-99-8 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=9010-98-4 enrich_references.pubchem_identifier_url
cdc.gov https://www.cdc.gov/niosh-rtecs/EI92DDA8.html enrich_references.pubchem_identifier_url
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:39481 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.004.381 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0133 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID5020316 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=18589 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL555660 enrich_references.pubchem_identifier_url
gmelin gmelin:277888 enrich_references.chebi_xrefs
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/42L93DWV3A enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0250123 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J384K enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C19208 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C19208 enrich_references.pubchem_identifier_url
kegg.jp https://www.kegg.jp/entry/C19502 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=56322 enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C44356 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/31369 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#1991 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q410871 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Chloroprene enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
7f2cdc9a-10e8-4189-bc5c-cc52f74c769d Environmental → Air → Aircraft cruise height EF 3.1 kg 6
f712167b-1072-46ce-b261-f03b1c2fcc30 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 6
23a2f7cb-5363-4c9d-8eae-68df46d22e84 Environmental → Air → Indoor EF 3.1 kg 6
e6c64f10-fdce-44c8-9980-573937a668af Environmental → Air → Long-term EF 3.1 kg 0
bbc8d04e-1c47-4272-b162-a9ca4d2cd28e Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 6
f3895ac9-16aa-4ba6-89e8-54bed5cdbe1c Environmental → Air → Unknown EF 3.1 kg 6
898f270c-aa6a-4f90-85ed-34da9df00510 Environmental → Ground → Agricultural EF 3.1 kg 6
26ea8daf-ac95-4723-8ef4-55614f59cd87 Environmental → Ground → Non-agricultural EF 3.1 kg 6
eb041449-3fe6-4847-8468-b74743d8a836 Environmental → Ground → Unknown EF 3.1 kg 6
0876cf08-b8c6-4b4a-96fa-32038434b5f7 Environmental → Water → Long-term EF 3.1 kg 0
4e5eb5e5-c88e-4cb4-90dc-f96f88fe94d8 Environmental → Water → Ocean EF 3.1 kg 6
4e911cbf-77fe-4358-9a3e-6018682fc94c Environmental → Water → Surface water EF 3.1 kg 6
f514e49d-b89d-401b-9999-14f807255562 Environmental → Water → Unknown EF 3.1 kg 6

History

Everything that changed this substance (58 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-3305057839d0848a",
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      "@value": "Chloroprene",
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  ],
  "altLabel": [
    {
      "@value": "1,3-Butadiene, 2-chloro-",
      "@language": "en",
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    {
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    },
    {
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    },
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    },
    {
      "@value": "β-Chloroprene",
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  "properties": {
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