Chem
J-GLOBAL ID：201507006886752470   Nikkaji number：J3.437.519D

2,8-Diethyl-1,3,7,9-tetramethyl-4,4,10,10-tetraphenyl-3a,9a-diaza-5,11-dioxa-4,10-dibora(IV)dicyclopenta[a,h]anthracene

2,8-ジエチル-1,3,7,9-テトラメチル-4,4,10,10-テトラフェニル-3a,9a-ジアザ-5,11-ジオキサ-4,10-ジボラ(IV)ジシクロペンタ[a,h]アントラセン
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： C46H44B2N2O2
Molecular formula furigana： C46-H44-B2-N2-O2
Molecular weight： 678.490
InChI： InChI=1S/C46H44B2N2O2/c1-7-39-31(3)45-41-29-44-42(30-43(41)51-47(49(45)33(39)5,35-21-13-9-14-22-35)36-23-15-10-16-24-36)46-32(4)40(8-2)34(6)50(46)48(52-44,37-25-17-11-18-26-37)38-27-19-12-20-28-38/h9-30H,7-8H2,1-6H3
InChI key： NXEVKKVHYPHMQE-UHFFFAOYSA-N
SMILES： CCc1c(C)c2c3cc4O[B](c5ccccc5)(c5ccccc5)n5c(C)c(CC)c(C)c5c4cc3O[B](c3ccccc3)(c3ccccc3)n2c1C
Systematic name  (3)：
  • 2,8-ジエチル-1,3,7,9-テトラメチル-4,4,10,10-テトラフェニル-3a,9a-ジアザ-5,11-ジオキサ-4,10-ジボラ(IV)ジシクロペンタ[a,h]アントラセン
  • 6,16-ジエチル-5,7,15,17-テトラメチル-9,9,19,19-テトラフェニル-10,20-ジオキサ-8,18-ジアザ-9λ4,19λ4-ジボラペンタシクロ[11.7.0.03,11.04,8.014,18]イコサ-1,3(11),4,6,12,14,16-ヘプタエン
  • 6,16-diethyl-5,7,15,17-tetramethyl-9,9,19,19-tetraphenyl-10,20-dioxa-8,18-diaza-9λ4,19λ4-diborapentacyclo[11.7.0.03,11.04,8.014,18]icosa-1,3(11),4,6,12,14,16-heptaene
Other name (1)：
  • 2,8-Diethyl-1,3,7,9-tetramethyl-4,4,10,10-tetraphenyl-3a,9a-diaza-5,11-dioxa-4,10-dibora(IV)dicyclopenta[a,h]anthracene
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