2-Butenoic acid, 3-(3-chlorophenyl)-2-cyano-, ethyl ester
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2-Butenoic acid, 3-(3-chlorophenyl)-2-cyano-, ethyl ester
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CAS No:
473438-02-7
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Formula:
C13H12ClNO2
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Chemical Name:
2-Butenoic acid, 3-(3-chlorophenyl)-2-cyano-, ethyl ester
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Synonyms:
Ethyl 3-(3-chlorophenyl)-2-cyanobut-2-enoate;ZINC116507411
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CAS No:
Computed Properties
Molecular Weight:249.69
XLogP3:3.7
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:249.0556563
Monoisotopic Mass:249.0556563
Topological Polar Surface Area:50.1
Heavy Atom Count:17
Complexity:367
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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