Chem
J-GLOBAL ID：201807003787449416   Nikkaji number：J3.720.778K

1,3-Bis[5-(3,4,5-trihexadecylphenyl)-1H-pyrrole-2-yl]-3-[(difluoroboryl)oxy]-2-propene-1-one

1,3-ビス[5-(3,4,5-トリヘキサデシルフェニル)-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： C119H209BF2N2O2
Molecular formula furigana： C119-H209-B-F2-N2-O2
Molecular weight： 1748.800
InChI： InChI=1S/C119H209BF2N2O2/c1-7-13-19-25-31-37-43-49-55-61-67-73-79-85-91-106-101-110(102-107(92-86-80-74-68-62-56-50-44-38-32-26-20-14-8-2)112(106)95-89-83-77-71-65-59-53-47-41-35-29-23-17-11-5)114-97-99-116(123-114)118(125)105-119(126-120(121)122)117-100-98-115(124-117)111-103-108(93-87-81-75-69-63-57-51-45-39-33-27-21-15-9-3)113(96-90-84-78-72-66-60-54-48-42-36-30-24-18-12-6)109(104-111)94-88-82-76-70-64-58-52-46-40-34-28-22-16-10-4/h97-105,123-124H,7-96H2,1-6H3
InChI key： JIKGSMHFQVHHBI-UHFFFAOYSA-N
SMILES： CCCCCCCCCCCCCCCCc1cc(cc(CCCCCCCCCCCCCCCC)c1CCCCCCCCCCCCCCCC)c1ccc([nH]1)C(=O)C=C(OB(F)F)c1ccc([nH]1)c1cc(CCCCCCCCCCCCCCCC)c(CCCCCCCCCCCCCCCC)c(CCCCCCCCCCCCCCCC)c1
Systematic name  (3)：
  • 1,3-ビス[5-(3,4,5-トリヘキサデシルフェニル)-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
  • 3-オキソ-1,3-ビス[5-(3,4,5-トリヘキサデシルフェニル)-1H-ピロール-2-イル]プロパ-1-エン-1-イル ジフルオロボリナート
  • 3-oxo-1,3-bis[5-(3,4,5-trihexadecylphenyl)-1H-pyrrol-2-yl]prop-1-en-1-yl difluoroborinate
Other name (1)：
  • 1,3-Bis[5-(3,4,5-trihexadecylphenyl)-1H-pyrrole-2-yl]-3-[(difluoroboryl)oxy]-2-propene-1-one
Thsaurus map：
Thesaurus Map

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