2-ethylsulfanylpyridine-3-carboxylic acid
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2-ethylsulfanylpyridine-3-carboxylic acid
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CAS No:
27868-76-4
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Formula:
C8H9NO2S
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Chemical Name:
2-ethylsulfanylpyridine-3-carboxylic acid
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Synonyms:
Ethylthio-2-nicotinsaeure; 2-ethylthiopyridine-3-carboxylic acid; 2-(ETHYLTHIO)NICOTINIC ACID; 2-ethylsulfanylnicotinic acid;
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CAS No:
2-ethylsulfanylpyridine-3-carboxylic acid Basic Attributes
183.22800
183.03539970 g/mol
DTXSID30343715
2933399090
Characteristics
75.49000
1.89180
1.3g/cm3
185-187ºC
338.6ºC at 760 mmHg
158.6ºC
1.599
3.78E-05mmHg at 25°C
Computed Properties
Molecular Weight:183.23
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:183.03539970
Monoisotopic Mass:183.03539970
Topological Polar Surface Area:75.5
Heavy Atom Count:12
Complexity:163
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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