4-(4-Bromophenyl)-2-Methyl-5-Nitro-1,3-Oxazole

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Properties Simple | Detailed

Formula C10H7BrN2O3
IUPAC Name 4-(4-bromophenyl)-2-methyl-5-nitro-oxazole
Molecular Mass 283.078 g·mol−1
Heat of Formation 97.7 ± 16.7 kJ·mol−1
Dipole Moment 4.83 ± 1.08 D
Volume 256.51 Å 3
Surface Area 246.3 Å 2
HOMO Energy -9.78 ± 0.55 eV
LUMO Energy -1.54 ± eV
Point Group Symmetry Cs
Synonyms
  • 4-(4-bromophenyl)-2-methyl-5-nitrooxazole
  • oxazole, 4-(4-bromophenyl)-2-methyl-5-nitro-
  • s 20344
  • s-20344
CAS Number(s)
  • 78164-40-6
InChIKey FZEZSAYAMCCVHV-UHFFFAOYSA-N
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Elements H C O Br N