Ethyl β-cyano-4-nitrobenzenepropanoate
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Ethyl β-cyano-4-nitrobenzenepropanoate
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CAS No:
5473-14-3
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Formula:
C12H12N2O4
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Chemical Name:
Ethyl β-cyano-4-nitrobenzenepropanoate
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Synonyms:
Benzenepropanoic acid,β-cyano-4-nitro-,ethyl ester;Ethyl β-cyano-4-nitrobenzenepropanoate;NSC 29657
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CAS No:
Computed Properties
Molecular Weight:248.23
XLogP3:1.6
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:248.07970687
Monoisotopic Mass:248.07970687
Topological Polar Surface Area:95.9
Heavy Atom Count:18
Complexity:347
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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