(E)-2-(4-(2-cyanovinylsulfonyl)phenyl)-2-methylpropanoic acid
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(E)-2-(4-(2-cyanovinylsulfonyl)phenyl)-2-methylpropanoic acid
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CAS No:
1356089-38-7
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Formula:
C13H13NO4S
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Chemical Name:
(E)-2-(4-(2-cyanovinylsulfonyl)phenyl)-2-methylpropanoic acid
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Synonyms:
(E)-2-(4-((2-Cyanovinyl)sulfonyl)phenyl)-2-methylpropanoic acid;(E)-2-(4-(2-cyanovinylsulfonyl)phenyl)-2-methylpropanoic acid;CHEMBL1958384;SCHEMBL12477653;DTXSID50725418;ZINC73311887;AKOS016845572;AKOS025149253;2-[4-(2-Cyanoethenesulfonyl)phenyl]-2-Methyl-propanoic acid;2-[4-((E)-2-Cyano-ethenesulfonyl)-phenyl]-2-methyl-propionic acid
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CAS No:
(E)-2-(4-(2-cyanovinylsulfonyl)phenyl)-2-methylpropanoic acid Basic Attributes
279.31162
279.057
DTXSID50725418
Computed Properties
Molecular Weight:279.31
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:279.05652907
Monoisotopic Mass:279.05652907
Topological Polar Surface Area:104
Heavy Atom Count:19
Complexity:511
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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(E)-2-(4-(2-cyanovinylsulfonyl)phenyl)-2-methylpropanoic acid
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