Chem
J-GLOBAL ID:200907063848588387   Nikkaji number:J1.459.222I

(8aS)-2-[3,5-Bis(trifluoromethyl)phenyl]-2,3,8,8aα-tetrahydro-1H-2,3a-diaza-3-boracyclopenta[a]indene

(3aS)-2-[3,5-ビス(トリフルオロメチル)フェニル]-1H,2H,3H,3aH,4H-[1,3,2]ジアザボロロ[1,5-a]インドール
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: C17H13BF6N2
Molecular formula furigana: C17-H13-B-F6-N2
Molecular weight: 370.110
InChI: InChI=1S/C17H13BF6N2/c19-16(20,21)11-6-12(17(22,23)24)8-13(7-11)25-9-14-5-10-3-1-2-4-15(10)26(14)18-25/h1-4,6-8,14,18H,5,9H2/t14-/m0/s1
InChI key: NNJBDZHEDVRVAZ-AWEZNQCLSA-N
SMILES: FC(F)(F)c1cc(cc(c1)C(F)(F)F)N1BN2[C@H](C1)Cc1ccccc21
Systematic name  (3):
  • (8aS)-2-[3,5-ビス(トリフルオロメチル)フェニル]-2,3,8,8aα-テトラヒドロ-1H-2,3a-ジアザ-3-ボラシクロペンタ[a]インデン
  • (3aS)-2-[3,5-ビス(トリフルオロメチル)フェニル]-1H,2H,3H,3aH,4H-[1,3,2]ジアザボロロ[1,5-a]インドール
  • (3aS)-2-[3,5-bis(trifluoromethyl)phenyl]-1H,2H,3H,3aH,4H-[1,3,2]diazaborolo[1,5-a]indole
Other name (1):
  • (8aS)-2-[3,5-Bis(trifluoromethyl)phenyl]-2,3,8,8aα-tetrahydro-1H-2,3a-diaza-3-boracyclopenta[a]indene
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