Tert-Butyl (2-Sulfanylethyl)Carbamate

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Properties Simple | Detailed

Formula C7H15NO2S
IUPAC Name tert-butyl n-(2-sulfanylethyl)carbamate
Molecular Mass 177.264 g·mol−1
Heat of Formation -493.0 ± 16.7 kJ·mol−1
Dipole Moment 2.31 ± 1.08 D
Volume 227.19 Å 3
Surface Area 215.64 Å 2
HOMO Energy -8.89 ± 0.55 eV
LUMO Energy -0.27 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(boc-amino)ethanethiol
  • carbamic acid, (2-mercaptoethyl)-, 1,1-dimethylethyl ester
  • n-(2-mercaptoethyl)carbamic acid tert-butyl ester
  • n-(tert-butoxycarbonyl)-2-aminoethanethiol
  • n-boc-aet
  • tert-butyl n-(2-mercaptoethyl)carbamate
  • tert-butyl n-(2-sulfanylethyl)carbamate
CAS Number(s)
  • 67385-09-5
InChIKey GSJJCZSHYJNRPN-UHFFFAOYSA-N
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