ethyl (E)-2-cyano-3,5-dimethylhex-2-enoate
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ethyl (E)-2-cyano-3,5-dimethylhex-2-enoate
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CAS No:
53276-28-1
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Formula:
C11H17NO2
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Chemical Name:
ethyl (E)-2-cyano-3,5-dimethylhex-2-enoate
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Synonyms:
NSC110086;ZINC1702722;AKOS001061115;NSC-110086;Ethyl 2-cyano-3,5-dimethyl-2-hexenoate;2-Cyano-3,5-dimethyl-2-hexenoic acid ethyl ester;759-53-5
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CAS No:
Computed Properties
Molecular Weight:195.26
XLogP3:3.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:195.125928785
Monoisotopic Mass:195.125928785
Topological Polar Surface Area:50.1
Heavy Atom Count:14
Complexity:281
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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