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Methyl (βS)-β-(acetylamino)benzenepropanoate

Methyl (βS)-β-(acetylamino)benzenepropanoate structure

Methyl (βS)-β-(acetylamino)benzenepropanoate 

structure
  • CAS No:

    67654-58-4

  • Formula:

    C12H15NO3

  • Chemical Name:

    Methyl (βS)-β-(acetylamino)benzenepropanoate

  • Synonyms:

    Benzenepropanoic acid,β-(acetylamino)-,methyl ester,(βS)-;Benzenepropanoic acid,β-(acetylamino)-,methyl ester,(S)-;Methyl (βS)-β-(acetylamino)benzenepropanoate;(S)-Methyl 3-acetamido-3-phenylpropanoate;(S)-3-(Acetylamino)-3-phenylpropanoic acid methyl ester

  • Categories:

    Biochemical Engineering  >  Amino Acids and Derivatives

Methyl (βS)-β-(acetylamino)benzenepropanoate Basic Attributes

221.25

221.25

DTXSID20444043

2924299090

Characteristics

55.4

1.94980

1.115 g/cm3

99-101 °C

406.066ºC at 760 mmHg

1.514

Computed Properties

Molecular Weight:221.25
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:221.10519334
Monoisotopic Mass:221.10519334
Topological Polar Surface Area:55.4
Heavy Atom Count:16
Complexity:247
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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