2,3,4,5,6-Pentafluorophenyl 4-Methylbenzenesulfonate 2,3,4,5,6-五氟苯基4-甲基苯磺酸盐

CAS 2069-36-5 MFCD00060056

化学结构图

2069-36-5
SMILES: Cc1ccc(S(=O)(=O)Oc2c(F)c(F)c(F)c(F)c2F)cc1

化学属性

Mol. FormulaC13H7F5O3S
Mol. Weight338.25
Melting Point65-67 °C
Boiling Point372.9±42.0 °C at 760 mmHg

别名和识别编码

Chemical Name2,3,4,5,6-Pentafluorophenyl 4-Methylbenzenesulfonate
Alfabeta NamePENTAFLUOROPHENYLMETHYLBENZENESULFONATE 234564--,,,,
MDL NumberMFCD00060056
CAS Number2069-36-5
Chemical Name Translation2,3,4,5,6-五氟苯基4-甲基苯磺酸盐
LabNetwork Molecule IDLN00146501
PubChem Substance ID639958
InChIInChI=1S/C13H7F5O3S/c1-6-2-4-7(5-3-6)22(19,20)21-13-11(17)9(15)8(14)10(16)12(13)18/h2-5H,1H3
Synonym 2,3,4,5,6-Pentafluorophenyl 4-methylbenzenesulfonate {LY} 2,3,4,5,6-Pentafluorophenyl 4-methylbenzenesulfonate {} {LY} 2,3,4,5,6-Pentafluorophenyl 4-methylbenzenesulfonate {} {} {LY} 2,3,4,5,6-Pentafluorophenyl 4-methylbenzenesulfonate {} {} {} {LY} 2,3,4,5,6-Pentafluorophenyl 4-methylbenzenesulfonate {} {} {} {} {LY} 2,3,4,5,6-Pentafluorophenyl 4-methylbenzenesulfonate {} {} {} {} {} {LY} 2,3,4,5,6-Pentafluorophenyl 4-methylbenzenesulfonate {} {} {} {} {} {} {LY} 2,3,4,5,6-Pentafluorophenyl 4-methylbenzenesulfonate {} {} {} {} {} {} {} {LY} 2,3,4,5,6-Pentafluorophenyl 4-methylbenzenesulfonate {} {} {} {} {} {} {} {} {LY} 2,3,4,5,6-Pentafluorophenyl 4-methylbenzenesulfonate {} {} {} {} {} {} {} {} {} {LY} 2,3,4,5,6-Pentafluorophenyl 4-methylbenzenesulfonate {} {} {} {} {} {} {} {} {} {} {LY} 2,3,4,5,6-Pentafluorophenyl 4-methylbenzenesulfonate {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3,4,5,6-Pentafluorophenyl 4-methylbenzenesulfonate {} {} {} {} {} {} {} {} {} {} {}
Canonical SMILESCC1=CC=C(C=C1)S(=O)(=O)OC2=C(C(=C(C(=C2F)F)F)F)F
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分类

  • {KO} PFP Esters

安全信息

Warnings IRRITANT
Storage condition

药物吸收、分布、代谢与排泄(ADME)

H-bond Acceptors
3
Rotatable Bonds
3
H-bond Donors
0

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Chemicals by Class 化学分类法
  4. Halogenated 卤化物 (氟氯溴碘)
  5. Fluoro 氟化物
  1. Functional Group 官能团索引
  2. sulfonic acid ester

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