N-(2-Chloro-4-Isothiocyanatophenyl)-1-Hydroxy-2-Naphthamide

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Properties Simple | Detailed

Formula C18H11ClN2O2S
IUPAC Name n-(2-chloro-4-isothiocyanato-phenyl)-1-hydroxy-naphthalene-2-carboxamide
Molecular Mass 354.810 g·mol−1
Heat of Formation 35.1 ± 16.7 kJ·mol−1
Dipole Moment 8.56 ± 1.08 D
Volume 379.3 Å 3
Surface Area 345.11 Å 2
HOMO Energy -8.48 ± 0.55 eV
LUMO Energy -1.67 ± eV
Point Group Symmetry C1
Synonyms
  • 2'-chloro-1-hydroxy-2-naphthanilide-4'-isothiocyanate
  • 2-naphthalenecarboxamide, n-(2-chloro-4-isothiocyanatophenyl)-1-hydroxy-
  • compound 75-98
  • n-(2-chloro-4-isothiocyanato-phenyl)-1-hydroxy-2-naphthamide
  • n-(2-chloro-4-isothiocyanato-phenyl)-1-hydroxy-naphthalene-2-carboxamide
  • n-(2-chloro-4-isothiocyanatophenyl)-1-hydroxy-2-naphthalenecarboxamide
CAS Number(s)
  • 67728-25-0
InChIKey KCFHCMVMIBEPIJ-UHFFFAOYSA-N
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