N-Ethyl-1-(4-Isothiocyanato-2-Thienyl)Cyclohexanamine

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Properties Simple | Detailed

Formula C13H18N2S2
IUPAC Name n-ethyl-1-(4-isothiocyanato-2-thienyl)cyclohexanamine
Molecular Mass 266.425 g·mol−1
Heat of Formation 186.2 ± 16.7 kJ·mol−1
Dipole Moment 3.46 ± 1.08 D
Volume 328.13 Å 3
Surface Area 286.95 Å 2
HOMO Energy -8.57 ± 0.55 eV
LUMO Energy -1.16 ± eV
Point Group Symmetry C1
Synonyms
  • ethyl-[1-(4-isothiocyanato-2-thienyl)cyclohexyl]amine
  • itce-1,2,4
  • n-ethyl-1-(2-(4-isothiocyanothienyl))cyclohexylamine
  • n-ethyl-1-(4-isothiocyanato-2-thienyl)-1-cyclohexanamine
  • n-ethyl-1-(4-isothiocyanato-2-thienyl)cyclohexan-1-amine
  • n-ethyl-1-(4-isothiocyanatothiophen-2-yl)cyclohexan-1-amine
CAS Number(s)
  • 136811-74-0
InChIKey IHSZKUSHJRNQBN-UHFFFAOYSA-N
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