2-[(E)-3-phenylprop-2-enyl]sulfanylpyridine-3-carboxylic acid
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![2-[(E)-3-phenylprop-2-enyl]sulfanylpyridine-3-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/00056ecedd7342e2b17c020b2ba69f36.png "2-[(E)-3-phenylprop-2-enyl]sulfanylpyridine-3-carboxylic acid")
2-[(E)-3-phenylprop-2-enyl]sulfanylpyridine-3-carboxylic acid
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CAS No:
324779-96-6
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Formula:
C15H13NO2S
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Chemical Name:
2-[(E)-3-phenylprop-2-enyl]sulfanylpyridine-3-carboxylic acid
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Synonyms:
324779-96-6;2-{[(2E)-3-PHENYLPROP-2-EN-1-YL]THIO}NICOTINIC ACID;2-(Cinnamylthio)nicotinic acid;CHEMBRDG-BB 5919697;ZINC2383716;MFCD01795583;STK806721;AKOS000203064;BS-37730;ST50775916;W-8625;SR-01000442349;SR-01000442349-1;2-{[(2E)-3-Phenyl-2-propen-1-yl]thio}nicotinic acid;2-((2E)-3-phenylprop-2-enylthio)pyridine-3-carboxylic acid;2-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}pyridine-3-carboxylic acid
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CAS No:
2-[(E)-3-phenylprop-2-enyl]sulfanylpyridine-3-carboxylic acid Basic Attributes
271.3 g/mol
271.06669983 g/mol
DTXSID70386904
Computed Properties
Molecular Weight:271.3
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:271.06669983
Monoisotopic Mass:271.06669983
Topological Polar Surface Area:75.5
Heavy Atom Count:19
Complexity:313
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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