Chem
J-GLOBAL ID：200907063329958401
Nikkaji number：J1.309.125K
(S)-1-(4-Nitrophenyl)-2-nitroethanol
(S)-1-(4-ニトロフェニル)-2-ニトロエタノール
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： C8H8[N+]2O3[O-]2
Molecular formula furigana： C8-H8-N2-O5
Molecular weight： 212.161
InChI：
InChI=1S/C8H8N2O5/c11-8(5-9(12)13)6-1-3-7(4-2-6)10(14)15/h1-4,8,11H,5H2/t8-/m1/s1
InChI key：
IBGLUMJSLYZZRX-MRVPVSSYSA-N
SMILES：
O[C@H](C[N+](=O)[O-])c1ccc(cc1)[N+](=O)[O-]
Systematic name (8)：
- (S)-1-(4-ニトロフェニル)-2-ニトロエタノール
- (S)-α-(ニトロメチル)-4-ニトロベンゼンメタノール
- (1S)-1-(4-ニトロフェニル)-2-ニトロエタノール
- (S)-4-ニトロ-α-(ニトロメチル)ベンジルアルコール
- (S)-α-(ニトロメチル)-4-ニトロベンジルアルコール
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- (S)-1-(4-Nitrophenyl)-2-nitroethanol
- (S)-α-(Nitromethyl)-4-nitrobenzenemethanol
- (1S)-1-(4-Nitrophenyl)-2-nitroethanol
- (S)-4-Nitro-α-(nitromethyl)benzyl alcohol
- (S)-α-(Nitromethyl)-4-nitrobenzyl alcohol
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