Chem
J-GLOBAL ID：201107000376422796   Nikkaji number：J2.956.421C

4,4-Difluoro-8-[4-(hydroxyamino)-3-nitrophenyl]-1,3,5,7-tetramethyl-3a-azonia-4a-aza-4-bora(IV)-s-indacene

4,4-ジフルオロ-8-[4-(ヒドロキシアミノ)-3-ニトロフェニル]-1,3,5,7-テトラメチル-3a-アゾニア-4a-アザ-4-ボラ(IV)-s-インダセン
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： C19H19BF2N2[N+]2O2[O-]
Molecular formula furigana： C19-H19-B-F2-N4-O3
Molecular weight： 400.190
InChI： InChI=1S/C19H19BF2N4O3/c1-10-7-12(3)24-18(10)17(14-5-6-15(23-27)16(9-14)26(28)29)19-11(2)8-13(4)25(19)20(24,21)22/h5-9,23,27H,1-4H3/q+1
InChI key： HCILSRVDAFEHPW-UHFFFAOYSA-N
SMILES： CC1=CC(=[N+]2C1=C(c1c(C)cc(C)n1[B]2(F)F)c1ccc(NO)c(c1)[N+](=O)[O-])C
Systematic name  (3)：
  • 4,4-ジフルオロ-8-[4-(ヒドロキシアミノ)-3-ニトロフェニル]-1,3,5,7-テトラメチル-3a-アゾニア-4a-アザ-4-ボラ(IV)-s-インダセン
  • 2,2-ジフルオロ-8-[4-(ヒドロキシアミノ)-3-ニトロフェニル]-4,6,10,12-テトラメチル-1λ5,3-ジアザ-2λ4-ボラトリシクロ[7.3.0.03,7]ドデカ-1(12),4,6,8,10-ペンタエン-1-イリウム
  • 2,2-difluoro-8-[4-(hydroxyamino)-3-nitrophenyl]-4,6,10,12-tetramethyl-1λ5,3-diaza-2λ4-boratricyclo[7.3.0.03,7]dodeca-1(12),4,6,8,10-pentaen-1-ylium
Other name (1)：
  • 4,4-Difluoro-8-[4-(hydroxyamino)-3-nitrophenyl]-1,3,5,7-tetramethyl-3a-azonia-4a-aza-4-bora(IV)-s-indacene
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