4-(2,5-Dioxo-2,5-Dihydro-1H-Pyrrol-1-Yl)-N-{3-[3-(Trifluoromethyl)-3H-Diaziren-3-Yl]Phenyl}Butanamide

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Formula C16H13F3N4O3
IUPAC Name 4-(2,5-dioxopyrrol-1-yl)-n-[3-[3-(trifluoromethyl)diazirin-3-yl]phenyl]butanamide
Molecular Mass 366.295 g·mol−1
Heat of Formation -554.1 ± 16.7 kJ·mol−1
Dipole Moment 3.84 ± 1.08 D
Volume 395.73 Å 3
Surface Area 361.12 Å 2
HOMO Energy -9.32 ± 0.55 eV
LUMO Energy -1.58 ± eV
Point Group Symmetry C1
Synonyms
  • 1h-pyrrole-1-butanamide, 2,5-dihydro-2,5-dioxo-n-(3-(3-(trifluoromethyl)-3h-diazirin-3-yl)phenyl)-
  • 4-(2,5-dioxo-1-pyrrolyl)-n-[3-[3-(trifluoromethyl)-3-diazirinyl]phenyl]butanamide
  • 4-(2,5-dioxopyrrol-1-yl)-n-[3-[3-(trifluoromethyl)-1,2-diazirin-3-yl]phenyl]butanamide
  • 4-(2,5-dioxopyrrol-1-yl)-n-[3-[3-(trifluoromethyl)diazirin-3-yl]phenyl]butanamide
  • 4-maleimido-n-[3-[3-(trifluoromethyl)diazirin-3-yl]phenyl]butyramide
  • n-(2-(3-(trifluoromethyl)diazirin-3-yl)phenyl)-4-maleimidobutyramide
  • n-(m-(3-(trifluoromethyl)-diazirin-3-yl)phenyl)-4-maleimidobutyramide
  • tdpmb
CAS Number(s)
  • 151077-62-2
InChIKey MRRHBQSFTWKYPQ-UHFFFAOYSA-N
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