6-Nitroveratraldehyde

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Properties Simple | Detailed

Formula C9H9NO5
IUPAC Name 4,5-dimethoxy-2-nitro-benzaldehyde
Molecular Mass 211.171 g·mol−1
Heat of Formation -344.2 ± 16.7 kJ·mol−1
Dipole Moment 7.46 ± 1.08 D
Volume 233.65 Å 3
Surface Area 223.99 Å 2
HOMO Energy -9.85 ± 0.55 eV
LUMO Energy -1.40 ± eV
Point Group Symmetry C1
Synonyms
  • 3,4-dimethoxy-6-nitrobenzaldehyde
  • 4,5-dimethoxy-2-nitrobenzaldehyde
  • 4,5-dimethoxy-6-nitrobenzaldehyde
  • ae-641/30608009
  • benzaldehyde, 4,5-dimethoxy-2-nitro-
  • dmnb
  • dna-dependent protein kinase inhibitor
  • dna-pk inhibitor
  • hsci1_000095
  • oprea1_551791
CAS Number(s)
  • 20357-25-9
InChIKey YWSPWKXREVSQCA-UHFFFAOYSA-N
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