2-(2-phenylethylsulfanyl)ethyl pyridine-3-carboxylate
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2-(2-phenylethylsulfanyl)ethyl pyridine-3-carboxylate
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CAS No:
101952-70-9
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Formula:
C16H17NO2S
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Chemical Name:
2-(2-phenylethylsulfanyl)ethyl pyridine-3-carboxylate
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Synonyms:
2-(Phenethylthio)ethyl nicotinate;101952-70-9;NICOTINIC ACID, 2-(PHENETHYLTHIO)ETHYL ESTER;BRN 0228325;ACMC-20m4yo;DTXSID30144421;2-(Phenethylthio)ethyl=nicotinate;3-Pyridinecarboxylicacid, 2-[(2-phenylethyl)thio]ethyl ester;ZINC1852623
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CAS No:
2-(2-phenylethylsulfanyl)ethyl pyridine-3-carboxylate Basic Attributes
287.4 g/mol
287.09799996 g/mol
DTXSID30144421
Computed Properties
Molecular Weight:287.4
XLogP3:3.6
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:287.09799996
Monoisotopic Mass:287.09799996
Topological Polar Surface Area:64.5
Heavy Atom Count:20
Complexity:280
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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