Basic information Safety Supplier Related

N-CYANOACETYLURETHANE

Basic information Safety Supplier Related

N-CYANOACETYLURETHANE Basic information

Product Name:
N-CYANOACETYLURETHANE
Synonyms:
  • N-Cyanoacetylurethane 98%
  • Ethyl (2-cyanoacetyl)
  • 2-Cyanoacetylurethane
  • Carbamic acid, (cyanoacetyl)-, ethyl ester
  • cyanoacetyl-carbamicaciethylester
  • Cyanoacetylurethan
  • Ethyl cyanacetylcarbamate
  • N-Cyanoacetyl ethyl carbamate
CAS:
6629-04-5
MF:
C6H8N2O3
MW:
156.14
EINECS:
229-615-4
Product Categories:
  • intermediate
  • 1
Mol File:
6629-04-5.mol
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N-CYANOACETYLURETHANE Chemical Properties

Melting point:
167-169 °C (lit.)
Boiling point:
280.35°C (rough estimate)
Density 
1.197
refractive index 
1.5010 (estimate)
storage temp. 
2-8°C
solubility 
DMSO, Methanol
form 
Solid
pka
3.46±0.10(Predicted)
color 
Pale Yellow
InChI
InChI=1S/C6H8N2O3/c1-2-11-6(10)8-5(9)3-4-7/h2-3H2,1H3,(H,8,9,10)
InChIKey
HSOGVWWWGVFXGF-UHFFFAOYSA-N
SMILES
C(OCC)(=O)NC(CC#N)=O
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Safety Information

Hazard Codes 
Xn
Risk Statements 
20/21/22-36/37/38
Safety Statements 
26-37/39
WGK Germany 
3
RTECS 
EZ3480000
HazardClass 
IRRITANT
HS Code 
2926907090

MSDS

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N-CYANOACETYLURETHANE Usage And Synthesis

Chemical Properties

Pale Yellow Solid

Uses

N-Cyanoacetylurethane is used in the synthesis of inhibitors targetting the PDZ domain of PICK1, which is a potential target for brain ischemia, pain and addiction illnesses. Also it is used in the synthesis of cathespin K inhibitors.

N-CYANOACETYLURETHANESupplier

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025-86950358 13390612682
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