Chem
J-GLOBAL ID：200907096651537760   Nikkaji number：J2.057.318J

1-[10-[4-[1,3,7,9-Tetramethyl-5,5-difluoro-5-bora(IV)-10H-dipyrrolo[1,2-c:2′,1′-f]pyrimidine-10-yl]phenoxy]decyl]-1H-imidazole

1-[10-[4-[1,3,7,9-テトラメチル-5,5-ジフルオロ-5-ボラ(IV)-10H-ジピロロ[1,2-c:2′,1′-f]ピリミジン-10-イル]フェノキシ]デシル]-1H-イミダゾール
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： C32H42BF2N4O
Molecular formula furigana： C32-H42-B-F2-N4-O
Molecular weight： 547.520
InChI： InChI=1S/C32H42BF2N4O/c1-24-21-26(3)38-31(24)30(32-25(2)22-27(4)39(32)33(38,34)35)28-13-15-29(16-14-28)40-20-12-10-8-6-5-7-9-11-18-37-19-17-36-23-37/h13-17,19,21-23,30H,5-12,18,20H2,1-4H3
InChI key： PRLCHHBFVSWOEX-UHFFFAOYSA-N
SMILES： Cc1cc(C)n2c1C(c1c(C)cc(C)n1[B]2(F)F)c1ccc(OCCCCCCCCCCn2ccnc2)cc1
Systematic name  (3)：
  • 1-[10-[4-[1,3,7,9-テトラメチル-5,5-ジフルオロ-5-ボラ(IV)-10H-ジピロロ[1,2-c:2′,1′-f]ピリミジン-10-イル]フェノキシ]デシル]-1H-イミダゾール
  • 2,2-ジフルオロ-8-(4-{[10-(1H-イミダゾール-1-イル)デシル]オキシ}フェニル)-4,6,10,12-テトラメチル-1,3-ジアザ-2λ4-ボラトリシクロ[7.3.0.03,7]ドデカ-4,6,9,11-テトラエン
  • 2,2-difluoro-8-(4-{[10-(1H-imidazol-1-yl)decyl]oxy}phenyl)-4,6,10,12-tetramethyl-1,3-diaza-2λ4-boratricyclo[7.3.0.03,7]dodeca-4,6,9,11-tetraene
Other name (1)：
  • 1-[10-[4-[1,3,7,9-Tetramethyl-5,5-difluoro-5-bora(IV)-10H-dipyrrolo[1,2-c:2′,1′-f]pyrimidine-10-yl]phenoxy]decyl]-1H-imidazole
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