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Home > Encyclopedia > 2-(Phenylthio)benzeneacetic acid

2-(Phenylthio)benzeneacetic acid

2-(Phenylthio)benzeneacetic acid structure

2-(Phenylthio)benzeneacetic acid 

structure
  • CAS No:

    1527-17-9

  • Formula:

    C14H12O2S

  • Chemical Name:

    2-(Phenylthio)benzeneacetic acid

  • Synonyms:

    Benzeneacetic acid,2-(phenylthio)-;Acetic acid,[o-(phenylthio)phenyl]-;2-(Phenylthio)benzeneacetic acid;2-(Phenylthio)phenylacetic acid;2-(2-(Phenylthio)phenyl)acetic acid;BTB 15078

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

2-(Phenylthio)benzeneacetic acid Basic Attributes

244.30900

244.31

DTXSID80165106

2930909090

Characteristics

62.60000

3.46490

1.27g/cm3

123 °C

205 °C @ Press: 1.2 Torr

193.5ºC

1.656

Safety Information

R36/37/38

S26-S37/39

Xi: Irritant;

Computed Properties

Molecular Weight:244.31
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:244.05580079
Monoisotopic Mass:244.05580079
Topological Polar Surface Area:62.6
Heavy Atom Count:17
Complexity:249
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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