Consensus flow list

Identity

Type
Neutral molecule
CAS
79-44-7
EC
201-208-6
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Dimethylcarbamoyl Chloride

Alternative labels

16

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string YIIMEMSDCNDGTB-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C3H6ClNO/c1-5(2)3(4)6/h1-2H3
IUPAC name chemrof:IUPAC_name Dimethylcarbamoyl Chloride
Molecular formula chemrof:molecular_formula C3H6ClNO
Molecular mass chemrof:molecular_mass 107.54
Monoisotopic mass chemrof:monoisotopic_mass 107.01379, 107.013791
SMILES string chemrof:smiles_string CN(C)C(=O)Cl

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=79-44-7 enrich_references.chebi_xrefs
cdc.gov https://www.cdc.gov/niosh-rtecs/FD401640.html enrich_references.pubchem_identifier_url
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:82280 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.001.099 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID1020512 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=122671 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1527556 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/5D54S95GT6 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.844J enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C19175 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C19175 enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C44378 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/6598 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#2262 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q2563907 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Dimethylcarbamoyl_chloride enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
e2fb04ea-6555-11dd-ad8b-0800200c9a66 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
4d9a8790-3ddd-11dd-8f30-0050c2490048 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
fc9ca447-af91-42a3-8bff-55d708698149 Environmental → Air → Indoor EF 3.1 kg 2
4d9a8790-3ddd-11dd-8f2f-0050c2490048 Environmental → Air → Long-term EF 3.1 kg 0
4d9a8790-3ddd-11dd-8f31-0050c2490048 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
4d9a8790-3ddd-11dd-8f2e-0050c2490048 Environmental → Air → Unknown EF 3.1 kg 2
4d9a8790-3ddd-11dd-8f2c-0050c2490048 Environmental → Ground → Agricultural EF 3.1 kg 2
4d9a8790-3ddd-11dd-8f35-0050c2490048 Environmental → Ground → Non-agricultural EF 3.1 kg 2
4d9a8790-3ddd-11dd-8f2d-0050c2490048 Environmental → Ground → Unknown EF 3.1 kg 2
4d9a8790-3ddd-11dd-8f33-0050c2490048 Environmental → Water → Long-term EF 3.1 kg 0
4d9a8790-3ddd-11dd-8f36-0050c2490048 Environmental → Water → Ocean EF 3.1 kg 2
4d9a8790-3ddd-11dd-8f32-0050c2490048 Environmental → Water → Surface water EF 3.1 kg 2
4d9a8790-3ddd-11dd-8f34-0050c2490048 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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  "altLabel": [
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      "@value": "Carbamic chloride, N,N-dimethyl-",
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    {
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