2-(2-cyanoacetyl)benzoic acid
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2-(2-cyanoacetyl)benzoic acid
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CAS No:
50454-25-6
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Formula:
C10H7NO3
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Chemical Name:
2-(2-cyanoacetyl)benzoic acid
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Synonyms:
50454-25-6;2-(cyanoacetyl)benzoic acid;2-(2-cyanoacetyl)benzoic acid;NSC87573;SCHEMBL7614948;DTXSID10293163;ZINC1562162;NSC-87573
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CAS No:
2-(2-cyanoacetyl)benzoic acid Basic Attributes
189.17 g/mol
189.042593085 g/mol
87573
DTXSID10293163
Computed Properties
Molecular Weight:189.17
XLogP3:0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:189.042593085
Monoisotopic Mass:189.042593085
Topological Polar Surface Area:78.2
Heavy Atom Count:14
Complexity:289
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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