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Details

Stereochemistry ACHIRAL
Molecular Formula C3H5NO
Molecular Weight 71.0779
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of ETHYL ISOCYANATE

SMILES

CCN=C=O

InChI

InChIKey=WUDNUHPRLBTKOJ-UHFFFAOYSA-N
InChI=1S/C3H5NO/c1-2-4-3-5/h2H2,1H3

HIDE SMILES / InChI

Molecular Formula C3H5NO
Molecular Weight 71.0779
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Synthesis, antiproliferative activity evaluation and structure-activity relationships of novel aromatic urea and amide analogues of N-phenyl-N'-(2-chloroethyl)ureas.
2010-07
Convenient headspace gas chromatographic determination of azide in blood and plasma.
2009-10
Validation of transferability of DBA derivatization and LC-MS/MS determination method for isocyanates via an interlaboratory comparison.
2008-11
Dipolar cycloaddition of ethyl isocyanoacetate to 3-chloro-2-(methylthio)/2-(methylsulfonyl)quinoxalines: highly regio- and chemoselective synthesis of substituted imidazo[1,5-a]quinoxaline-3-carboxylates.
2007-06-22
Validation of a diffusive sampling method for airborne low-molecular isocyanates using 4-nitro-7-piperazinobenzo-2-oxa-1,3-diazole-impregnated filters and liquid chromatography-tandem mass spectrometry.
2006-11-17
Synthesis and evaluation of 3-aminopropionyl substituted fentanyl analogues for opioid activity.
2006-09-15
Cyclization reactions of acylium and thioacylium ions with isocyanates and isothiocyanates: gas phase synthesis of 3,4-dihydro-2,4-dioxo-2H-1,3,5-oxadiazinium ions.
2005-10
Validation of a solvent-free sampler for the determination of low molecular weight aliphatic isocyanates under thermal degradation conditions.
2005-09
Diversity-oriented synthesis of functionalized pyrrolo[3,2-d]pyrimidines with variation of the pyrimidine ring nitrogen substituents.
2003-09-05
A practical synthesis of cabergoline.
2002-10-04
Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 22:21:50 GMT 2025
Edited
by admin
on Mon Mar 31 22:21:50 GMT 2025
Record UNII
B02YQ4MIR0
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ETHYL ISOCYANATE
Systematic Name English
NSC-89687
Preferred Name English
ETHANE, ISOCYANATO-
Systematic Name English
ISOCYANIC ACID, ETHYL ESTER
Systematic Name English
ISOCYANATOETHANE [HSDB]
Common Name English
Code System Code Type Description
CHEBI
85107
Created by admin on Mon Mar 31 22:21:50 GMT 2025 , Edited by admin on Mon Mar 31 22:21:50 GMT 2025
PRIMARY
CAS
109-90-0
Created by admin on Mon Mar 31 22:21:50 GMT 2025 , Edited by admin on Mon Mar 31 22:21:50 GMT 2025
PRIMARY
NSC
89687
Created by admin on Mon Mar 31 22:21:50 GMT 2025 , Edited by admin on Mon Mar 31 22:21:50 GMT 2025
PRIMARY
ECHA (EC/EINECS)
203-717-9
Created by admin on Mon Mar 31 22:21:50 GMT 2025 , Edited by admin on Mon Mar 31 22:21:50 GMT 2025
PRIMARY
HSDB
6318
Created by admin on Mon Mar 31 22:21:50 GMT 2025 , Edited by admin on Mon Mar 31 22:21:50 GMT 2025
PRIMARY
EPA CompTox
DTXSID5059379
Created by admin on Mon Mar 31 22:21:50 GMT 2025 , Edited by admin on Mon Mar 31 22:21:50 GMT 2025
PRIMARY
PUBCHEM
8022
Created by admin on Mon Mar 31 22:21:50 GMT 2025 , Edited by admin on Mon Mar 31 22:21:50 GMT 2025
PRIMARY
FDA UNII
B02YQ4MIR0
Created by admin on Mon Mar 31 22:21:50 GMT 2025 , Edited by admin on Mon Mar 31 22:21:50 GMT 2025
PRIMARY