1,3-Dimethyl-1-[5-(Trifluoromethyl)-1,3,4-Thiadiazol-2-Yl]Urea

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Properties Simple | Detailed

Formula C6H7F3N4OS
IUPAC Name 1,3-dimethyl-1-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]urea
Molecular Mass 240.206 g·mol−1
Heat of Formation -608.4 ± 16.7 kJ·mol−1
Dipole Moment 3.79 ± 1.08 D
Volume 235.41 Å 3
Surface Area 228.67 Å 2
HOMO Energy -9.66 ± 0.55 eV
LUMO Energy 1.16 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3,4-thiadiazole, 2-(n,n'-dimethylureido)-5-trifluoromethyl-
  • 1,3-dimethyl-1-(5-trifluoromethyl-1,3,4-thiadiazol-2-yl)urea
  • 2-(n,n'-dimethylureido)-5-trifluoromethyl-1,3,4-thiadiazole
  • dmttu
  • erbotan
  • gs 29296
  • n,n'-dimethyl-n-(5-trifluoromethyl-1,3,4-thiadiazol-2-yl)urea
  • thiazafluron
  • thiazafluron [bsi:iso]
  • thiazfluron
  • urea, 1,3-dimethyl-1-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-
  • urea, n,n'-dimethyl-n-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-
CAS Number(s)
  • 25366-23-8
InChIKey BBJPZPLAZVZTGR-UHFFFAOYSA-N
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