N-{[(2,2-Dimethylpropanoyl)Amino]Methyl}-L-Cysteine

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Properties Simple | Detailed

Formula C9H18N2O3S
IUPAC Name (2r)-2-[(2,2-dimethylpropanoylamino)methylamino]-3-sulfanyl-propanoic acid
Molecular Mass 234.316 g·mol−1
Heat of Formation -638.7 ± 16.7 kJ·mol−1
Dipole Moment 3.77 ± 1.08 D
Volume 291.08 Å 3
Surface Area 268.45 Å 2
HOMO Energy -9.08 ± 0.55 eV
LUMO Energy -0.46 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-2-[(2,2-dimethylpropanoylamino)methylamino]-3-sulfanyl-propanoic acid
  • (2r)-2-[(2,2-dimethylpropanoylamino)methylamino]-3-sulfanylpropanoic acid
  • (2r)-2-[[(2,2-dimethyl-1-oxopropyl)amino]methylamino]-3-mercaptopropanoic acid
  • (2r)-3-mercapto-2-[(pivaloylamino)methylamino]propionic acid
  • cys-tacm
  • trimethylacetamidomethylcysteine
CAS Number(s)
  • 125700-47-2
InChIKey UBENVAHPSYMDLE-LURJTMIESA-N
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