2-[(4-Methylphenyl)thio]-3-pyridinecarboxylic acid
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2-[(4-Methylphenyl)thio]-3-pyridinecarboxylic acid
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CAS No:
955-53-3
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Formula:
C13H11NO2S
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Chemical Name:
2-[(4-Methylphenyl)thio]-3-pyridinecarboxylic acid
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Synonyms:
3-Pyridinecarboxylic acid,2-[(4-methylphenyl)thio]-;Nicotinic acid,2-(p-tolylthio)-;2-[(4-Methylphenyl)thio]-3-pyridinecarboxylic acid;2-(4-Methylphenylthio)pyridine-3-carboxylic acid;2-[(4-Methylphenyl)thio]nicotinic acid;2-[(4-Methylphenyl)sulfanyl]pyridine-3-carboxylic acid;2-(p-Tolylthio)nicotinic acid
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CAS No:
Computed Properties
Molecular Weight:245.30
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:245.05104977
Monoisotopic Mass:245.05104977
Topological Polar Surface Area:75.5
Heavy Atom Count:17
Complexity:264
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2-[(4-Methylphenyl)thio]-3-pyridinecarboxylic acid
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