1-cyanoethyl benzoate
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1-cyanoethyl benzoate
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CAS No:
3478-24-8
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Formula:
C10H9NO2
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Chemical Name:
1-cyanoethyl benzoate
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Synonyms:
1-cyanoethyl benzoate;3478-24-8;NSC142045;SCHEMBL1344032;Benzoic acid 1-cyanoethyl ester;CHEMBL4520984;DTXSID10301252;AKOS023429580;MCULE-1367906762;NE25326;NSC-142045;Z19825292
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CAS No:
Computed Properties
Molecular Weight:175.18
XLogP3:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:175.063328530
Monoisotopic Mass:175.063328530
Topological Polar Surface Area:50.1
Heavy Atom Count:13
Complexity:222
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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