2-CYANO-3-PHENYLPROPIONICACID
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2-CYANO-3-PHENYLPROPIONICACID
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CAS No:
5331-42-0
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Formula:
C10H9NO2
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Chemical Name:
2-CYANO-3-PHENYLPROPIONICACID
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Synonyms:
2-Cyano-3-phenylpropionic acid;2-CYANO-3-PHENYLPROPANOIC ACID;NSC2286;Benzenepropanoic acid, alpha-cyano-;phenylmethylcyanoacetic acid;alpha-Cyanohydrocinnamic acid;SCHEMBL1344165;Benzenepropanoic acid, a-cyano-;CTK4J7567;DTXSID60277418
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CAS No:
Computed Properties
Molecular Weight:175.18
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:175.063328530
Monoisotopic Mass:175.063328530
Topological Polar Surface Area:61.1
Heavy Atom Count:13
Complexity:222
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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