Chem
J-GLOBAL ID：200907060146992881   Nikkaji number：J1.157.259F

2-[2-(4,5,7-Trinitro-9-oxo-9H-fluorene-2-ylcarbonyloxy)ethoxy]ethanol 3,4,5-tris(5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-heptadecafluorododecyloxy)benzoate

3,4,5-トリス(5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-ヘプタデカフルオロドデシルオキシ)安息香酸2-[2-(4,5,7-トリニトロ-9-オキソ-9H-フルオレン-2-イルカルボニルオキシ)エトキシ]エチル
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： C61H38F51[N+]3O12[O-]3
Molecular formula furigana： C61-H38-F51-N3-O15
Molecular weight： 2021.900
InChI： InChI=1S/C61H38F51N3O15/c62-38(63,41(68,69)44(74,75)47(80,81)50(86,87)53(92,93)56(98,99)59(104,105)106)7-1-4-10-126-30-19-24(37(118)130-16-14-125-13-15-129-36(117)23-17-26-32(28(18-23)114(121)122)33-27(34(26)116)21-25(113(119)120)22-29(33)115(123)124)20-31(127-11-5-2-8-39(64,65)42(70,71)45(76,77)48(82,83)51(88,89)54(94,95)57(100,101)60(107,108)109)35(30)128-12-6-3-9-40(66,67)43(72,73)46(78,79)49(84,85)52(90,91)55(96,97)58(102,103)61(110,111)112/h17-22H,1-16H2
InChI key： SDQODZHXPYHGKI-UHFFFAOYSA-N
SMILES： [O-][N+](=O)c1cc2C(=O)c3cc(cc(c3c2c(c1)[N+](=O)[O-])[N+](=O)[O-])C(=O)OCCOCCOC(=O)c1cc(OCCCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c(OCCCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c(OCCCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c1
Systematic name  (6)：
  • 3-オキサ-1,5-ペンタンジオール1-[3,4,5-トリス(5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-ヘプタデカフルオロドデシルオキシ)ベンゾアート]5-(2,4,5-トリニトロ-9-オキソ-9H-フルオレン-7-カルボキシラート)
  • 3,4,5-トリス(5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-ヘプタデカフルオロドデシルオキシ)安息香酸2-[2-[(4,5,7-トリニトロ-9-オキソ-9H-フルオレン-2-イル)カルボニルオキシ]エトキシ]エチル
  • 2-[2-(4,5,7-トリニトロ-9-オキソ-9H-フルオレン-2-イルカルボニルオキシ)エトキシ]エタノール3,4,5-トリス(5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-ヘプタデカフルオロドデシルオキシ)ベンゾアート
  • 3,4,5-トリス(5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-ヘプタデカフルオロドデシルオキシ)安息香酸2-[2-(4,5,7-トリニトロ-9-オキソ-9H-フルオレン-2-イルカルボニルオキシ)エトキシ]エチル
  • 2-[2-(4,5,7-トリニトロ-9-オキソ-9H-フルオレン-2-カルボニルオキシ)エトキシ]エチル 3,4,5-トリス[(5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-ヘプタデカフルオロドデシル)オキシ]ベンゾアート
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Other name (4)：
  • 3-Oxa-1,5-pentanediol 1-[3,4,5-tris(5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-heptadecafluorododecyloxy)benzoate]5-(2,4,5-trinitro-9-oxo-9H-fluorene-7-carboxylate)
  • 3,4,5-Tris(5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-heptadecafluorododecyloxy)benzoic acid 2-[2-[(4,5,7-trinitro-9-oxo-9H-fluorene-2-yl)carbonyloxy]ethoxy]ethyl ester
  • 2-[2-(4,5,7-Trinitro-9-oxo-9H-fluorene-2-ylcarbonyloxy)ethoxy]ethanol 3,4,5-tris(5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-heptadecafluorododecyloxy)benzoate
  • 3,4,5-Tris(5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-heptadecafluorododecyloxy)benzoic acid 2-[2-(4,5,7-trinitro-9-oxo-9H-fluorene-2-ylcarbonyloxy)ethoxy]ethyl ester
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