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Home > Encyclopedia > 3,3′-Dithiobis[benzoic acid]

3,3′-Dithiobis[benzoic acid]

3,3′-Dithiobis[benzoic acid] structure

3,3′-Dithiobis[benzoic acid] 

structure
  • CAS No:

    1227-49-2

  • Formula:

    C14H10O4S2

  • Chemical Name:

    3,3′-Dithiobis[benzoic acid]

  • Synonyms:

    Benzoic acid,3,3′-dithiobis-;Benzoic acid,3,3′-dithiodi-;3,3′-Dithiobis[benzoic acid];3,3′-Dithiodibenzoic acid;NSC 113997;3,3′-Disulfanediyldibenzoic acid;3-[(3-Carboxyphenyl)disulfanyl]benzoic acid

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

3,3′-Dithiobis[benzoic acid] Basic Attributes

306.357

306.36

602-892-2

113997

DTXSID20297096

2930909090

Characteristics

125.20000

3.92

1.5±0.1 g/cm3

246 °C

537.9±35.0 °C at 760 mmHg

279.1±25.9 °C

1.736

Computed Properties

Molecular Weight:306.4
XLogP3:3.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:306.00205114
Monoisotopic Mass:306.00205114
Topological Polar Surface Area:125
Heavy Atom Count:20
Complexity:327
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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