Chem
J-GLOBAL ID：201007066131678829   Nikkaji number：J2.834.196B

7-[4-[1,3,5,7-Tetramethyl-4,4-difluoro-3a-azonia-4-bora(IV)-4H-4a-aza-s-indacene-8-yl]phenylethynyl]-9,9-bis(3,6-dioxaheptane-1-yl)-2-ethynyl-9H-fluorene

2-エチニル-7-[4-[1,3,5,7-テトラメチル-4,4-ジフルオロ-4H-3a-アゾニア-4-ボラ(IV)-4a-アザ-s-インダセン-8-イル]フェニルエチニル]-9,9-ビス[2-(2-メトキシエトキシ)エチル]-9H-フルオレン
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： C46H47BF2N[N+]O4
Molecular formula furigana： C46-H47-B-F2-N2-O4
Molecular weight： 740.700
InChI： InChI=1S/C46H47BF2N2O4/c1-8-35-13-17-39-40-18-14-37(30-42(40)46(41(39)29-35,19-21-54-25-23-52-6)20-22-55-26-24-53-7)10-9-36-11-15-38(16-12-36)43-44-31(2)27-33(4)50(44)47(48,49)51-34(5)28-32(3)45(43)51/h1,11-18,27-30H,19-26H2,2-7H3/q+1
InChI key： IPZSZHLFPBZHTL-UHFFFAOYSA-N
SMILES： COCCOCCC1(CCOCCOC)c2cc(ccc2c2ccc(cc12)C#Cc1ccc(cc1)C1=C2C(=CC(=[N+]2[B](F)(F)n2c(C)cc(C)c12)C)C)C#C
Systematic name  (4)：
  • 2-エチニル-7-[4-[1,3,5,7-テトラメチル-4,4-ジフルオロ-4H-3a-アゾニア-4-ボラ(IV)-4a-アザ-s-インダセン-8-イル]フェニルエチニル]-9,9-ビス[2-(2-メトキシエトキシ)エチル]-9H-フルオレン
  • 7-[4-[1,3,5,7-テトラメチル-4,4-ジフルオロ-3a-アゾニア-4-ボラ(IV)-4H-4a-アザ-s-インダセン-8-イル]フェニルエチニル]-9,9-ビス(3,6-ジオキサヘプタン-1-イル)-2-エチニル-9H-フルオレン
  • 8-[4-(2-{7-エチニル-9,9-ビス[2-(2-メトキシエトキシ)エチル]-9H-フルオレン-2-イル}エチニル)フェニル]-2,2-ジフルオロ-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
  • 8-[4-(2-{7-ethynyl-9,9-bis[2-(2-methoxyethoxy)ethyl]-9H-fluoren-2-yl}ethynyl)phenyl]-2,2-difluoro-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 (2)：
  • 2-Ethynyl-7-[4-[1,3,5,7-tetramethyl-4,4-difluoro-4H-3a-azonia-4-bora(IV)-4a-aza-s-indacene-8-yl]phenylethynyl]-9,9-bis[2-(2-methoxyethoxy)ethyl]-9H-fluorene
  • 7-[4-[1,3,5,7-Tetramethyl-4,4-difluoro-3a-azonia-4-bora(IV)-4H-4a-aza-s-indacene-8-yl]phenylethynyl]-9,9-bis(3,6-dioxaheptane-1-yl)-2-ethynyl-9H-fluorene
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