Cas no 75172-11-1 ((2S)-2-methyl-3-sulfanylpropanoic acid)

(2S)-2-methyl-3-sulfanylpropanoic acid structure
75172-11-1 structure
Product Name:(2S)-2-methyl-3-sulfanylpropanoic acid
CAS No:75172-11-1
MF:C4H8O2S
MW:120.170120239258
MDL:MFCD19228475
CID:3037719
PubChem ID:10154042
Update Time:2025-04-21

(2S)-2-methyl-3-sulfanylpropanoic acid Chemical and Physical Properties

Names and Identifiers

    • (S)-3-mercapto-2-methylpropanoic acid
    • (2S)-2-methyl-3-sulfanylpropanoic acid
    • Q27458730
    • 75172-11-1
    • MHRDCHHESNJQIS-GSVOUGTGSA-N
    • AKOS006379776
    • SCHEMBL3742130
    • Propanoic acid, 3-mercapto-2-methyl-, (S)-
    • (2s)-3-mercapto-2-methylpropionic acid
    • CHEMBL123260
    • 2(S)-methyl-3-mercaptopropionic acid
    • MDL: MFCD19228475
    • Inchi: 1S/C4H8O2S/c1-3(2-7)4(5)6/h3,7H,2H2,1H3,(H,5,6)/t3-/m1/s1
    • InChI Key: MHRDCHHESNJQIS-GSVOUGTGSA-N
    • SMILES: SC[C@H](C(=O)O)C

Computed Properties

  • Exact Mass: 120.02500
  • Monoisotopic Mass: 120.02450067Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 7
  • Rotatable Bond Count: 2
  • Complexity: 72.1
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.6
  • Topological Polar Surface Area: 38.3?2

Experimental Properties

  • PSA: 76.10000
  • LogP: 0.63690

(2S)-2-methyl-3-sulfanylpropanoic acid Pricemore >>

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