Chem
J-GLOBAL ID:200907096338596844   Nikkaji number:J1.701.617B

3-(2-Nitro-4-bromophenyl)-1,2-propanediol diacetate

3-(2-ニトロ-4-ブロモフェニル)-1,2-プロパンジオールジアセタート
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C13H14Br[N+]O5[O-]
Molecular formula furigana: C13-H14-BR-N-O6
Molecular weight: 360.160
InChI: InChI=1S/C13H14BrNO6/c1-8(16)20-7-12(21-9(2)17)5-10-3-4-11(14)6-13(10)15(18)19/h3-4,6,12H,5,7H2,1-2H3
InChI key: MZPLXQJHCIKDEL-UHFFFAOYSA-N
SMILES: CC(=O)OCC(Cc1ccc(Br)cc1[N+](=O)[O-])OC(=O)C
Systematic name  (3):
  • 3-(2-ニトロ-4-ブロモフェニル)-1,2-プロパンジオールジアセタート
  • 1-(アセチルオキシ)-3-(4-ブロモ-2-ニトロフェニル)プロパン-2-イル アセタート
  • 1-(acetyloxy)-3-(4-bromo-2-nitrophenyl)propan-2-yl acetate
Other name (1):
  • 3-(2-Nitro-4-bromophenyl)-1,2-propanediol diacetate
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