4-(2-chloroethylsulfanyl)pyridine-3-carboxylic acid
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4-(2-chloroethylsulfanyl)pyridine-3-carboxylic acid
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CAS No:
13096-15-6
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Formula:
C8H8ClNO2S
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Chemical Name:
4-(2-chloroethylsulfanyl)pyridine-3-carboxylic acid
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Synonyms:
4-(2-chloro-ethylsulfanyl)-nicotinic acid; 4-(2-Chloroethylthio)nicotinic acid; 3-Pyridinecarboxylic acid,4-(2-chloroethylthio); Nicotinic acid,4-(2-chloroethylthio); 4-(2-Chloroethylthio)-3-pyridinecarboxylic acid;
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CAS No:
4-(2-chloroethylsulfanyl)pyridine-3-carboxylic acid Basic Attributes
217.67300
216.9964274 g/mol
DTXSID80156812
2933399090
Computed Properties
Molecular Weight:217.67
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:216.9964274
Monoisotopic Mass:216.9964274
Topological Polar Surface Area:75.5
Heavy Atom Count:13
Complexity:180
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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