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Home > Encyclopedia > Acetic acid, [(3-hydroxy-2-pyridinyl)thio]-, methyl ester (9CI)

Acetic acid, [(3-hydroxy-2-pyridinyl)thio]-, methyl ester (9CI)

Acetic acid, [(3-hydroxy-2-pyridinyl)thio]-, methyl ester (9CI) structure

Acetic acid, [(3-hydroxy-2-pyridinyl)thio]-, methyl ester (9CI) 

structure
  • CAS No:

    477716-68-0

  • Formula:

    C8H9NO3S

  • Chemical Name:

    Acetic acid, [(3-hydroxy-2-pyridinyl)thio]-, methyl ester (9CI)

  • Synonyms:

    Methyl [(3-hydroxy-2-pyridinyl)sulfanyl]acetate;SCHEMBL3238599;CTK8I8336;ZINC39117417;3-hydroxy-2-(methoxycarbonyl)methylthiopyridine;methyl 2-(3-hydroxypyridin-2-yl)sulfanylacetate

Acetic acid, [(3-hydroxy-2-pyridinyl)thio]-, methyl ester (9CI) Basic Attributes

199.22696

199.03

Characteristics

84.7

1.3

Computed Properties

Molecular Weight:199.23
XLogP3:1.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:199.03031432
Monoisotopic Mass:199.03031432
Topological Polar Surface Area:84.7
Heavy Atom Count:13
Complexity:177
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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