N-.α.-T-Boc-S-Benzyl-L-Cysteine

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Properties Simple | Detailed

Formula C15H21NO4S
IUPAC Name (2r)-3-benzylsulfanyl-2-(tert-butoxycarbonylamino)propanoic acid
Molecular Mass 311.397 g·mol−1
Heat of Formation -758.1 ± 16.7 kJ·mol−1
Dipole Moment 1.64 ± 1.08 D
Volume 381.14 Å 3
Surface Area 326.34 Å 2
HOMO Energy -8.71 ± 0.55 eV
LUMO Energy -0.14 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-2-(tert-butoxycarbonylamino)-3-(phenylmethylsulfanyl)propanoic acid
  • (2r)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(phenylmethylsulfanyl)propanoic acid
  • (2r)-2-[(tert-butoxy-oxomethyl)amino]-3-(phenylmethylthio)propanoic acid
  • (2r)-3-(benzylthio)-2-(tert-butoxycarbonylamino)propionic acid
  • boc-cys(bzl)-oh
InChIKey IFVORPLRHYROAA-LBPRGKRZSA-N
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