bis(2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate);bis(methyl 2-methylprop-2-enoate);bis(methyl prop-2-enoate);3,3,3-trifluoro-2-[3-(2-methylprop-2-enoyloxy)butanoyloxy]-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-[4-(2-methylprop-2-enoyloxy)cyclohexanecarbonyl]oxy-2-(trifluoromethyl)propane-1-sulfonate;bis(3,3,3-trifluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)-2-(trifluoromethyl)propane-1-sulfonate);3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(4-prop-2-enoyloxycyclohexanecarbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate

C136H145F54O70S9-9 — CID 159178733

IUPACbis(2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate);bis(methyl 2-methylprop-2-enoate);bis(methyl prop-2-enoate);3,3,3-trifluoro-2-[3-(2-methylprop-2-enoyloxy)butanoyloxy]-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-[4-(2-methylprop-2-enoyloxy)cyclohexanecarbonyl]oxy-2-(trifluoromethyl)propane-1-sulfonate;bis(3,3,3-trifluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)-2-(trifluoromethyl)propane-1-sulfonate);3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(4-prop-2-enoyloxycyclohexanecarbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate
SMILESC=C(C)C(=O)OC.C=C(C)C(=O)OC.C=C(C)C(=O)OC(C)CC(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F.C=C(C)C(=O)OC1CCC(C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)CC1.C=CC(=O)OC.C=CC(=O)OC.C=CC(=O)OC1C2CC3C1OC(=O)C3C2C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F.C=CC(=O)OC1C2OC(=O)C3C2OC1C3C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F.C=CC(=O)OC1CCC(C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)CC1.O=C(OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)C1CC2CCC1C2.O=C(OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)C1CC2CCC1C2.O=C(OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)C1CC2CCC1O2.O=C(OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)C1CC2CCC1O2
InChIInChI=1S/C16H14F6O9S.C15H12F6O10S.C15H18F6O7S.C14H16F6O7S.C12H14F6O7S.2C12H14F6O5S.2C11H12F6O6S.2C5H8O2.2C4H6O2/c1-2-7(23)29-10-6-3-5-8(12(24)30-11(5)10)9(6)13(25)31-14(15(17,18)19,16(20,21)22)4-32(26,27)28;1-2-4(22)28-9-8-6(5-7(29-8)10(9)30-11(5)23)12(24)31-13(14(16,17)18,15(19,20)21)3-32(25,26)27;1-8(2)11(22)27-10-5-3-9(4-6-10)12(23)28-13(14(16,17)18,15(19,20)21)7-29(24,25)26;1-2-10(21)26-9-5-3-8(4-6-9)11(22)27-12(13(15,16)17,14(18,19)20)7-28(23,24)25;1-6(2)9(20)24-7(3)4-8(19)25-10(11(13,14)15,12(16,17)18)5-26(21,22)23;2*13-11(14,15)10(12(16,17)18,5-24(20,21)22)23-9(19)8-4-6-1-2-7(8)3-6;2*12-10(13,14)9(11(15,16)17,4-24(19,20)21)23-8(18)6-3-5-1-2-7(6)22-5;2*1-4(2)5(6)7-3;2*1-3-4(5)6-2/h2,5-6,8-11H,1,3-4H2,(H,26,27,28);2,5-10H,1,3H2,(H,25,26,27);9-10H,1,3-7H2,2H3,(H,24,25,26);2,8-9H,1,3-7H2,(H,23,24,25);7H,1,4-5H2,2-3H3,(H,21,22,23);2*6-8H,1-5H2,(H,20,21,22);2*5-7H,1-4H2,(H,19,20,21);2*1H2,2-3H3;2*3H,1H2,2H3/p-9
InChIKeyKMPOOZGQAIKMME-UHFFFAOYSA-E
MW4214.08 g/mol
LogP17.42
Rot. Bonds51

About bis(2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate);bis(methyl 2-methylprop-2-enoate);bis(methyl prop-2-enoate);3,3,3-trifluoro-2-[3-(2-methylprop-2-enoyloxy)butanoyloxy]-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-[4-(2-methylprop-2-enoyloxy)cyclohexanecarbonyl]oxy-2-(trifluoromethyl)propane-1-sulfonate;bis(3,3,3-trifluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)-2-(trifluoromethyl)propane-1-sulfonate);3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(4-prop-2-enoyloxycyclohexanecarbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate

bis(2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate);bis(methyl 2-methylprop-2-enoate);bis(methyl prop-2-enoate);3,3,3-trifluoro-2-[3-(2-methylprop-2-enoyloxy)butanoyloxy]-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-[4-(2-methylprop-2-enoyloxy)cyclohexanecarbonyl]oxy-2-(trifluoromethyl)propane-1-sulfonate;bis(3,3,3-trifluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)-2-(trifluoromethyl)propane-1-sulfonate);3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(4-prop-2-enoyloxycyclohexanecarbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate (PubChem CID 159178733) has the molecular formula C136H145F54O70S9-9 and a molecular weight of 4214.08 g/mol. Its IUPAC name is bis(2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate);bis(methyl 2-methylprop-2-enoate);bis(methyl prop-2-enoate);3,3,3-trifluoro-2-[3-(2-methylprop-2-enoyloxy)butanoyloxy]-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-[4-(2-methylprop-2-enoyloxy)cyclohexanecarbonyl]oxy-2-(trifluoromethyl)propane-1-sulfonate;bis(3,3,3-trifluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)-2-(trifluoromethyl)propane-1-sulfonate);3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(4-prop-2-enoyloxycyclohexanecarbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate.

Molecular Properties

Compound Namebis(2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate);bis(methyl 2-methylprop-2-enoate);bis(methyl prop-2-enoate);3,3,3-trifluoro-2-[3-(2-methylprop-2-enoyloxy)butanoyloxy]-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-[4-(2-methylprop-2-enoyloxy)cyclohexanecarbonyl]oxy-2-(trifluoromethyl)propane-1-sulfonate;bis(3,3,3-trifluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)-2-(trifluoromethyl)propane-1-sulfonate);3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(4-prop-2-enoyloxycyclohexanecarbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate
PubChem CID159178733
Molecular FormulaC136H145F54O70S9-9
Molecular Weight4214.08 g/mol
Exact Mass4211.45
IUPAC Namebis(2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate);bis(methyl 2-methylprop-2-enoate);bis(methyl prop-2-enoate);3,3,3-trifluoro-2-[3-(2-methylprop-2-enoyloxy)butanoyloxy]-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-[4-(2-methylprop-2-enoyloxy)cyclohexanecarbonyl]oxy-2-(trifluoromethyl)propane-1-sulfonate;bis(3,3,3-trifluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)-2-(trifluoromethyl)propane-1-sulfonate);3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(4-prop-2-enoyloxycyclohexanecarbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate
SMILESC=C(C)C(=O)OC.C=C(C)C(=O)OC.C=C(C)C(=O)OC(C)CC(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F.C=C(C)C(=O)OC1CCC(C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)CC1.C=CC(=O)OC.C=CC(=O)OC.C=CC(=O)OC1C2CC3C1OC(=O)C3C2C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F.C=CC(=O)OC1C2OC(=O)C3C2OC1C3C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F.C=CC(=O)OC1CCC(C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)CC1.O=C(OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)C1CC2CCC1C2.O=C(OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)C1CC2CCC1C2.O=C(OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)C1CC2CCC1O2.O=C(OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)C1CC2CCC1O2
InChIInChI=1S/C16H14F6O9S.C15H12F6O10S.C15H18F6O7S.C14H16F6O7S.C12H14F6O7S.2C12H14F6O5S.2C11H12F6O6S.2C5H8O2.2C4H6O2/c1-2-7(23)29-10-6-3-5-8(12(24)30-11(5)10)9(6)13(25)31-14(15(17,18)19,16(20,21)22)4-32(26,27)28;1-2-4(22)28-9-8-6(5-7(29-8)10(9)30-11(5)23)12(24)31-13(14(16,17)18,15(19,20)21)3-32(25,26)27;1-8(2)11(22)27-10-5-3-9(4-6-10)12(23)28-13(14(16,17)18,15(19,20)21)7-29(24,25)26;1-2-10(21)26-9-5-3-8(4-6-9)11(22)27-12(13(15,16)17,14(18,19)20)7-28(23,24)25;1-6(2)9(20)24-7(3)4-8(19)25-10(11(13,14)15,12(16,17)18)5-26(21,22)23;2*13-11(14,15)10(12(16,17)18,5-24(20,21)22)23-9(19)8-4-6-1-2-7(8)3-6;2*12-10(13,14)9(11(15,16)17,4-24(19,20)21)23-8(18)6-3-5-1-2-7(6)22-5;2*1-4(2)5(6)7-3;2*1-3-4(5)6-2/h2,5-6,8-11H,1,3-4H2,(H,26,27,28);2,5-10H,1,3H2,(H,25,26,27);9-10H,1,3-7H2,2H3,(H,24,25,26);2,8-9H,1,3-7H2,(H,23,24,25);7H,1,4-5H2,2-3H3,(H,21,22,23);2*6-8H,1-5H2,(H,20,21,22);2*5-7H,1-4H2,(H,19,20,21);2*1H2,2-3H3;2*3H,1H2,2H3/p-9
InChIKeyKMPOOZGQAIKMME-UHFFFAOYSA-E
XLogP17.42
TPSA1068.49 Ų
H-Bond Donors
H-Bond Acceptors70
Rotatable Bonds51
Heavy Atoms269
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004214.08
LogP ≤ 517.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1070

Analyze bis(2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate);bis(methyl 2-methylprop-2-enoate);bis(methyl prop-2-enoate);3,3,3-trifluoro-2-[3-(2-methylprop-2-enoyloxy)butanoyloxy]-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-[4-(2-methylprop-2-enoyloxy)cyclohexanecarbonyl]oxy-2-(trifluoromethyl)propane-1-sulfonate;bis(3,3,3-trifluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)-2-(trifluoromethyl)propane-1-sulfonate);3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(4-prop-2-enoyloxycyclohexanecarbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of bis(2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate);bis(methyl 2-methylprop-2-enoate);bis(methyl prop-2-enoate);3,3,3-trifluoro-2-[3-(2-methylprop-2-enoyloxy)butanoyloxy]-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-[4-(2-methylprop-2-enoyloxy)cyclohexanecarbonyl]oxy-2-(trifluoromethyl)propane-1-sulfonate;bis(3,3,3-trifluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)-2-(trifluoromethyl)propane-1-sulfonate);3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(4-prop-2-enoyloxycyclohexanecarbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate?
The IUPAC name of bis(2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate);bis(methyl 2-methylprop-2-enoate);bis(methyl prop-2-enoate);3,3,3-trifluoro-2-[3-(2-methylprop-2-enoyloxy)butanoyloxy]-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-[4-(2-methylprop-2-enoyloxy)cyclohexanecarbonyl]oxy-2-(trifluoromethyl)propane-1-sulfonate;bis(3,3,3-trifluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)-2-(trifluoromethyl)propane-1-sulfonate);3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(4-prop-2-enoyloxycyclohexanecarbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate (CID 159178733) is bis(2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate);bis(methyl 2-methylprop-2-enoate);bis(methyl prop-2-enoate);3,3,3-trifluoro-2-[3-(2-methylprop-2-enoyloxy)butanoyloxy]-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-[4-(2-methylprop-2-enoyloxy)cyclohexanecarbonyl]oxy-2-(trifluoromethyl)propane-1-sulfonate;bis(3,3,3-trifluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)-2-(trifluoromethyl)propane-1-sulfonate);3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(4-prop-2-enoyloxycyclohexanecarbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate.
What is the SMILES notation for bis(2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate);bis(methyl 2-methylprop-2-enoate);bis(methyl prop-2-enoate);3,3,3-trifluoro-2-[3-(2-methylprop-2-enoyloxy)butanoyloxy]-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-[4-(2-methylprop-2-enoyloxy)cyclohexanecarbonyl]oxy-2-(trifluoromethyl)propane-1-sulfonate;bis(3,3,3-trifluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)-2-(trifluoromethyl)propane-1-sulfonate);3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(4-prop-2-enoyloxycyclohexanecarbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate?
The canonical SMILES for bis(2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate);bis(methyl 2-methylprop-2-enoate);bis(methyl prop-2-enoate);3,3,3-trifluoro-2-[3-(2-methylprop-2-enoyloxy)butanoyloxy]-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-[4-(2-methylprop-2-enoyloxy)cyclohexanecarbonyl]oxy-2-(trifluoromethyl)propane-1-sulfonate;bis(3,3,3-trifluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)-2-(trifluoromethyl)propane-1-sulfonate);3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(4-prop-2-enoyloxycyclohexanecarbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate is C=C(C)C(=O)OC.C=C(C)C(=O)OC.C=C(C)C(=O)OC(C)CC(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F.C=C(C)C(=O)OC1CCC(C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)CC1.C=CC(=O)OC.C=CC(=O)OC.C=CC(=O)OC1C2CC3C1OC(=O)C3C2C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F.C=CC(=O)OC1C2OC(=O)C3C2OC1C3C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F.C=CC(=O)OC1CCC(C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)CC1.O=C(OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)C1CC2CCC1C2.O=C(OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)C1CC2CCC1C2.O=C(OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)C1CC2CCC1O2.O=C(OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)C1CC2CCC1O2.
What is the InChIKey of bis(2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate);bis(methyl 2-methylprop-2-enoate);bis(methyl prop-2-enoate);3,3,3-trifluoro-2-[3-(2-methylprop-2-enoyloxy)butanoyloxy]-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-[4-(2-methylprop-2-enoyloxy)cyclohexanecarbonyl]oxy-2-(trifluoromethyl)propane-1-sulfonate;bis(3,3,3-trifluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)-2-(trifluoromethyl)propane-1-sulfonate);3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(4-prop-2-enoyloxycyclohexanecarbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate?
The InChIKey is KMPOOZGQAIKMME-UHFFFAOYSA-E. The full InChI is InChI=1S/C16H14F6O9S.C15H12F6O10S.C15H18F6O7S.C14H16F6O7S.C12H14F6O7S.2C12H14F6O5S.2C11H12F6O6S.2C5H8O2.2C4H6O2/c1-2-7(23)29-10-6-3-5-8(12(24)30-11(5)10)9(6)13(25)31-14(15(17,18)19,16(20,21)22)4-32(26,27)28;1-2-4(22)28-9-8-6(5-7(29-8)10(9)30-11(5)23)12(24)31-13(14(16,17)18,15(19,20)21)3-32(25,26)27;1-8(2)11(22)27-10-5-3-9(4-6-10)12(23)28-13(14(16,17)18,15(19,20)21)7-29(24,25)26;1-2-10(21)26-9-5-3-8(4-6-9)11(22)27-12(13(15,16)17,14(18,19)20)7-28(23,24)25;1-6(2)9(20)24-7(3)4-8(19)25-10(11(13,14)15,12(16,17)18)5-26(21,22)23;2*13-11(14,15)10(12(16,17)18,5-24(20,21)22)23-9(19)8-4-6-1-2-7(8)3-6;2*12-10(13,14)9(11(15,16)17,4-24(19,20)21)23-8(18)6-3-5-1-2-7(6)22-5;2*1-4(2)5(6)7-3;2*1-3-4(5)6-2/h2,5-6,8-11H,1,3-4H2,(H,26,27,28);2,5-10H,1,3H2,(H,25,26,27);9-10H,1,3-7H2,2H3,(H,24,25,26);2,8-9H,1,3-7H2,(H,23,24,25);7H,1,4-5H2,2-3H3,(H,21,22,23);2*6-8H,1-5H2,(H,20,21,22);2*5-7H,1-4H2,(H,19,20,21);2*1H2,2-3H3;2*3H,1H2,2H3/p-9.
What are the key properties of bis(2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate);bis(methyl 2-methylprop-2-enoate);bis(methyl prop-2-enoate);3,3,3-trifluoro-2-[3-(2-methylprop-2-enoyloxy)butanoyloxy]-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-[4-(2-methylprop-2-enoyloxy)cyclohexanecarbonyl]oxy-2-(trifluoromethyl)propane-1-sulfonate;bis(3,3,3-trifluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)-2-(trifluoromethyl)propane-1-sulfonate);3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(4-prop-2-enoyloxycyclohexanecarbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate?
bis(2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate);bis(methyl 2-methylprop-2-enoate);bis(methyl prop-2-enoate);3,3,3-trifluoro-2-[3-(2-methylprop-2-enoyloxy)butanoyloxy]-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-[4-(2-methylprop-2-enoyloxy)cyclohexanecarbonyl]oxy-2-(trifluoromethyl)propane-1-sulfonate;bis(3,3,3-trifluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)-2-(trifluoromethyl)propane-1-sulfonate);3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(4-prop-2-enoyloxycyclohexanecarbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate has a molecular weight of 4214.08 g/mol, XLogP of 17.42, 51 rotatable bonds, 0 hydrogen bond donors, and 70 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate);bis(methyl 2-methylprop-2-enoate);bis(methyl prop-2-enoate);3,3,3-trifluoro-2-[3-(2-methylprop-2-enoyloxy)butanoyloxy]-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-[4-(2-methylprop-2-enoyloxy)cyclohexanecarbonyl]oxy-2-(trifluoromethyl)propane-1-sulfonate;bis(3,3,3-trifluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)-2-(trifluoromethyl)propane-1-sulfonate);3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(5-oxo-2-prop-2-enoyloxy-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(4-prop-2-enoyloxycyclohexanecarbonyl)oxy-2-(trifluoromethyl)propane-1-sulfonate is sourced from PubChem (CID 159178733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).