Chem
J-GLOBAL ID：201707011068817603   Nikkaji number：J3.640.828F

1,3-Bis(3,4-dimethyl-5-phenyl-1H-pyrrole-2-yl)-3-(difluoroboryloxy)-2-propene-1-one

1,3-ビス(3,4-ジメチル-5-フェニル-1H-ピロール-2-イル)-3-(ジフルオロボリルオキシ)-2-プロペン-1-オン
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： C27H25BF2N2O2
Molecular formula furigana： C27-H25-B-F2-N2-O2
Molecular weight： 458.320
InChI： InChI=1S/C27H25BF2N2O2/c1-16-18(3)26(31-24(16)20-11-7-5-8-12-20)22(33)15-23(34-28(29)30)27-19(4)17(2)25(32-27)21-13-9-6-10-14-21/h5-15,31-32H,1-4H3
InChI key： VPWQVIPIBDDYCP-UHFFFAOYSA-N
SMILES： Cc1c(C)c([nH]c1C(=O)C=C(OB(F)F)c1[nH]c(c(C)c1C)c1ccccc1)c1ccccc1
Systematic name  (4)：
  • 1,3-ビス(3,4-ジメチル-5-フェニル-1H-ピロール-2-イル)-3-(ジフルオロボリルオキシ)-2-プロペン-1-オン
  • 1,3-ビス(3,4-ジメチル-5-フェニル-1H-ピロール-2-イル)-3-[(ジフルオロボリル)オキシ]-2-プロペン-1-オン
  • 1,3-ビス(3,4-ジメチル-5-フェニル-1H-ピロール-2-イル)-3-オキソプロパ-1-エン-1-イル ジフルオロボリナート
  • 1,3-bis(3,4-dimethyl-5-phenyl-1H-pyrrol-2-yl)-3-oxoprop-1-en-1-yl difluoroborinate
Other name (2)：
  • 1,3-Bis(3,4-dimethyl-5-phenyl-1H-pyrrole-2-yl)-3-(difluoroboryloxy)-2-propene-1-one
  • 1,3-Bis(3,4-dimethyl-5-phenyl-1H-pyrrole-2-yl)-3-[(difluoroboryl)oxy]-2-propene-1-one
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