Chem
J-GLOBAL ID：200907012303474216
Nikkaji number：J897.139K
5-Nitro-[2,2′-[(1E,3E)-1,2,3,4-tetrafluoro-1,3-butadiene-1,4-diyl]bis(thiophene)]
5-ニトロ-[2,2′-[(1E,3E)-1,2,3,4-テトラフルオロ-1,3-ブタジエン-1,4-ジイル]ビス(チオフェン)]
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： C12H5F4[N+]O[O-]S2
Molecular formula furigana： C12-H5-F4-N-O2-S2
Molecular weight： 335.290
InChI：
InChI=1S/C12H5F4NO2S2/c13-9(6-2-1-5-20-6)11(15)12(16)10(14)7-3-4-8(21-7)17(18)19/h1-5H/b11-9+,12-10+
InChI key：
PLUYPTUDXMAGHS-WGDLNXRISA-N
SMILES：
[O-][N+](=O)c1ccc(s1)/C(=C(\F)/C(=C(\F)/c1cccs1)/F)/F
Systematic name (3)：
- 5-ニトロ-[2,2′-[(1E,3E)-1,2,3,4-テトラフルオロ-1,3-ブタジエン-1,4-ジイル]ビス(チオフェン)]
- 2-ニトロ-5-[(1E,3E)-1,2,3,4-テトラフルオロ-4-(チオフェン-2-イル)ブタ-1,3-ジエン-1-イル]チオフェン
- 2-nitro-5-[(1E,3E)-1,2,3,4-tetrafluoro-4-(thiophen-2-yl)buta-1,3-dien-1-yl]thiophene
- 5-Nitro-[2,2′-[(1E,3E)-1,2,3,4-tetrafluoro-1,3-butadiene-1,4-diyl]bis(thiophene)]
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