Ethyl N-(2-cyanoacetyl)carbamate
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Ethyl N-(2-cyanoacetyl)carbamate
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CAS No:
6629-04-5
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Formula:
C6H8N2O3
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Chemical Name:
Ethyl N-(2-cyanoacetyl)carbamate
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Synonyms:
Carbamic acid,N-(2-cyanoacetyl)-,ethyl ester;Carbamic acid,(cyanoacetyl)-,ethyl ester;Ethyl N-(2-cyanoacetyl)carbamate;N-Cyanoacetylurethane;Ethyl cyanoacetylcarbamate;Cyanoacetylurethan;N-Carbethoxy-2-cyanoacetamide;Ethyl N-(cyanoacetyl)carbamate;NSC 59709;Ethyl (2-cyanoacetamido)formate
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CAS No:
Ethyl N-(2-cyanoacetyl)carbamate Basic Attributes
156.139
156.14
229-615-4
7L18CT33BN
59709
DTXSID50216497
2926909090
Safety Information
NONH for all modes of transport
3
20/21/22-36/37/38
S26;S37/S39
EZ3480000
Xn
P261-P280-P305 + P351 + P338
H302-H312-H315-H319-H332-H335
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Ethyl N-(2-cyanoacetyl)carbamate Use and Manufacturing
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 sy nthesis of cathespin K inhibitors.
Computed Properties
Molecular Weight:156.14
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:156.05349212
Monoisotopic Mass:156.05349212
Topological Polar Surface Area:79.2
Heavy Atom Count:11
Complexity:203
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Ethyl N-(2-cyanoacetyl)carbamate
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