Chem
J-GLOBAL ID:201507027328670723
Nikkaji number:J3.364.081A
Carbonic acid 3-(2,7-dibromo-9-methyl-9H-fluorene-9-yl)propyl 2-[5-[[4-(2-ethylhexyl)phenyl]ethynyl]-2-nitrophenyl]propyl ester
炭酸3-(2,7-ジブロモ-9-メチル-9H-フルオレン-9-イル)プロピル2-[5-[[4-(2-エチルヘキシル)フェニル]エチニル]-2-ニトロフェニル]プロピル
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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:
C43 H45 Br2 [N+]O4 [O-]
Molecular formula furigana:
C43-H45-BR2-N-O5
Molecular weight:
815.643
InChI:
InChI=1S/C43H45Br2NO5/c1-5-7-9-30(6-2)24-32-13-10-31(11-14-32)12-15-33-16-21-41(46(48)49)38(25-33)29(3)28-51-42(47)50-23-8-22-43(4)39-26-34(44)17-19-36(39)37-20-18-35(45)27-40(37)43/h10-11,13-14,16-21,25-27,29-30H,5-9,22-24,28H2,1-4H3
InChI key:
FRRYCJJVQVAFOL-UHFFFAOYSA-N
SMILES:
CCCCC(CC)Cc1ccc(cc1)C#Cc1ccc(c(c1)C(C)COC(=O)OCCCC1(C)c2cc(Br)ccc2c2ccc(Br)cc12)[N+](=O)[O-]
Systematic name (3):
炭酸3-(2,7-ジブロモ-9-メチル-9H-フルオレン-9-イル)プロピル2-[5-[[4-(2-エチルヘキシル)フェニル]エチニル]-2-ニトロフェニル]プロピル
3-(2,7-ジブロモ-9-メチル-9H-フルオレン-9-イル)プロピル 2-(5-{2-[4-(2-エチルヘキシル)フェニル]エチニル}-2-ニトロフェニル)プロピル カルボナート
3-(2,7-dibromo-9-methyl-9H-fluoren-9-yl)propyl 2-(5-{2-[4-(2-ethylhexyl)phenyl]ethynyl}-2-nitrophenyl)propyl carbonate
Other name (1):
Carbonic acid 3-(2,7-dibromo-9-methyl-9H-fluorene-9-yl)propyl 2-[5-[[4-(2-ethylhexyl)phenyl]ethynyl]-2-nitrophenyl]propyl ester
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