Chem
J-GLOBAL ID：200907002777865857
Nikkaji number：J2.707.955E
1,1-Dibromo-2-(1,3-benzodioxole-5-yl)-3-nitro-1-propene
1,1-ジブロモ-2-(1,3-ベンゾジオキソール-5-イル)-3-ニトロ-1-プロペン
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
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
Molecular formula： C10H7Br2[N+]O3[O-]
Molecular formula furigana： C10-H7-BR2-N-O4
Molecular weight： 364.977
InChI：
InChI=1S/C10H7Br2NO4/c11-10(12)7(4-13(14)15)6-1-2-8-9(3-6)17-5-16-8/h1-3H,4-5H2
InChI key：
FMQFLOVJCKNHGM-UHFFFAOYSA-N
SMILES：
[O-][N+](=O)CC(=C(Br)Br)c1ccc2OCOc2c1
Systematic name (3)：
- 1,1-ジブロモ-2-(1,3-ベンゾジオキソール-5-イル)-3-ニトロ-1-プロペン
- 5-(1,1-ジブロモ-3-ニトロプロパ-1-エン-2-イル)-2H-1,3-ベンゾジオキソール
- 5-(1,1-dibromo-3-nitroprop-1-en-2-yl)-2H-1,3-benzodioxole
- 1,1-Dibromo-2-(1,3-benzodioxole-5-yl)-3-nitro-1-propene
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