2-(2-pyridin-4-ylethylsulfanyl)acetic acid
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2-(2-pyridin-4-ylethylsulfanyl)acetic acid
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CAS No:
247109-12-2
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Formula:
C9H11NO2S
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Chemical Name:
2-(2-pyridin-4-ylethylsulfanyl)acetic acid
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Synonyms:
247109-12-2;2-(2-(4-pyridyl)ethylthio)acetic acid;2-[2-(4-pyridyl)ethylthio]acetic acid;(2-Pyridin-4-yl-ethylsulfanyl)-acetic acid;ChemDiv3_001411;Cambridge id 5103992;CBDivE_000371;SCHEMBL5069416;DTXSID30365558;HMS1477A03;ZINC2282901;CCG-16614;STK386952;AKOS000676328;MCULE-9455593841;IDI1_020377;{[2-(4-pyridinyl)ethyl]thio}acetic acid;ST50216676;{[2-(pyridin-4-yl)ethyl]sulfanyl}acetic acid
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CAS No:
2-(2-pyridin-4-ylethylsulfanyl)acetic acid Basic Attributes
197.26 g/mol
197.05104977 g/mol
DTXSID30365558
Computed Properties
Molecular Weight:197.26
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:197.05104977
Monoisotopic Mass:197.05104977
Topological Polar Surface Area:75.5
Heavy Atom Count:13
Complexity:158
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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