O-Isopropyl Ethylcarbamothioate

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Properties Simple | Detailed

Formula C6H13NOS
IUPAC Name o-isopropyl n-ethylcarbamothioate
Molecular Mass 147.239 g·mol−1
Heat of Formation -208.7 ± 16.7 kJ·mol−1
Dipole Moment 6.95 ± 1.08 D
Volume 195.77 Å 3
Surface Area 192.9 Å 2
HOMO Energy -8.29 ± 0.55 eV
LUMO Energy 3.11 ± eV
Point Group Symmetry C1
Synonyms
  • carbamic acid, ethylthio-, o-isopropyl ester
  • carbamothioic acid, ethyl-, o-(1-methylethyl) ester
  • ethylaminomethanethioic acid o-isopropyl ester
  • ethylcarbamothioic acid, o-(1-methylethyl) ester
  • ethylcarbamothioic acid, o-isopropyl ester
  • isopropylethyl thiocarbamate
  • o-isopropyl ethylaminomethanethioate
  • o-isopropyl ethylthiocarbamate
  • o-propan-2-yl ethylaminomethanethioate
  • z-200
CAS Number(s)
  • 141-98-0
InChIKey KIACEOHPIRTHMI-UHFFFAOYSA-N
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