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4-acetylsulfanylbutanoic acid

4-acetylsulfanylbutanoic acid structure

4-acetylsulfanylbutanoic acid 

structure
  • CAS No:

    101421-82-3

  • Formula:

    C6H10O3S

  • Chemical Name:

    4-acetylsulfanylbutanoic acid

  • Synonyms:

    4-acetylsulfanyl-butyric acid; Butanoic acid,4-(acetylthio); 4-Acetylmercapto-buttersaeure; 4-(acetylthio)butyric acid; S-acetyl-4-mercaptobutyric acid;

4-acetylsulfanylbutanoic acid Basic Attributes

162.20700

162.03506535

DTXSID10590942

Characteristics

79.67000

1.13090

1.216g/cm3

299.3ºC at 760 mmHg

134.8ºC

1.503

0.000285mmHg at 25°C

Computed Properties

Molecular Weight:162.21
XLogP3:0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:162.03506535
Monoisotopic Mass:162.03506535
Topological Polar Surface Area:79.7
Heavy Atom Count:10
Complexity:133
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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