2-(2-cyanoethoxycarbonyl)benzoic acid
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2-(2-cyanoethoxycarbonyl)benzoic acid
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CAS No:
31335-50-9
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Formula:
C11H9NO4
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Chemical Name:
2-(2-cyanoethoxycarbonyl)benzoic acid
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Synonyms:
31335-50-9;2-[(2-cyanoethoxy)carbonyl]benzoic acid;NSC38963;SCHEMBL10430715;DTXSID40284781;ZINC1671022;NSC-38963
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CAS No:
2-(2-cyanoethoxycarbonyl)benzoic acid Basic Attributes
219.19 g/mol
219.05315777 g/mol
38963
DTXSID40284781
Computed Properties
Molecular Weight:219.19
XLogP3:0.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:219.05315777
Monoisotopic Mass:219.05315777
Topological Polar Surface Area:87.4
Heavy Atom Count:16
Complexity:317
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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