2-[3-acetamido-5-[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-[3,5-bis[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-(3,5-diacetamido-2,4,6-trimethylbenzoyl)oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2-methoxy-4-methylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5,6-pentamethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,5,6-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(trifluoromethyl)-2-(2,3,5-trimethylbenzoyl)oxypropane-1-sulfonate

C130H134F48N6O47S8-8 — CID 161024361

About 2-[3-acetamido-5-[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-[3,5-bis[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-(3,5-diacetamido-2,4,6-trimethylbenzoyl)oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2-methoxy-4-methylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5,6-pentamethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,5,6-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(trifluoromethyl)-2-(2,3,5-trimethylbenzoyl)oxypropane-1-sulfonate

2-[3-acetamido-5-[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-[3,5-bis[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-(3,5-diacetamido-2,4,6-trimethylbenzoyl)oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2-methoxy-4-methylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5,6-pentamethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,5,6-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(trifluoromethyl)-2-(2,3,5-trimethylbenzoyl)oxypropane-1-sulfonate (PubChem CID 161024361) has the molecular formula C130H134F48N6O47S8-8 and a molecular weight of 3700.94 g/mol. Its IUPAC name is 2-[3-acetamido-5-[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-[3,5-bis[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-(3,5-diacetamido-2,4,6-trimethylbenzoyl)oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2-methoxy-4-methylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5,6-pentamethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,5,6-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(trifluoromethyl)-2-(2,3,5-trimethylbenzoyl)oxypropane-1-sulfonate.

Molecular Properties

• Compound Name: 2-[3-acetamido-5-[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-[3,5-bis[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-(3,5-diacetamido-2,4,6-trimethylbenzoyl)oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2-methoxy-4-methylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5,6-pentamethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,5,6-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(trifluoromethyl)-2-(2,3,5-trimethylbenzoyl)oxypropane-1-sulfonate
• PubChem CID: 161024361
• Molecular Formula: C130H134F48N6O47S8-8
• Molecular Weight: 3700.94 g/mol
• Exact Mass: 3698.53
• IUPAC Name: 2-[3-acetamido-5-[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-[3,5-bis[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-(3,5-diacetamido-2,4,6-trimethylbenzoyl)oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2-methoxy-4-methylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5,6-pentamethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,5,6-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(trifluoromethyl)-2-(2,3,5-trimethylbenzoyl)oxypropane-1-sulfonate
• SMILES: CC(=O)N(C)c1c(C)c(C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)c(C)c(N(C)C(C)=O)c1C.CC(=O)Nc1c(C)c(C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)c(C)c(N(C)C(C)=O)c1C.CC(=O)Nc1c(C)c(NC(C)=O)c(C)c(C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)c1C.COc1cc(C)ccc1C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F.Cc1c(C)c(C)c(C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)c(C)c1C.Cc1cc(C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)c(C)c(C)c1C.Cc1cc(C)c(C)c(C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)c1.Cc1cc(C)c(C)c(C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)c1C
• InChI: InChI=1S/C20H24F6N2O7S.C19H22F6N2O7S.C18H20F6N2O7S.C16H18F6O5S.2C15H16F6O5S.C14H14F6O5S.C13H12F6O6S/c1-9-14(10(2)16(28(7)13(5)30)11(3)15(9)27(6)12(4)29)17(31)35-18(19(21,22)23,20(24,25)26)8-36(32,33)34;1-8-13(9(2)15(27(6)12(5)29)10(3)14(8)26-11(4)28)16(30)34-17(18(20,21)22,19(23,24)25)7-35(31,32)33;1-7-12(8(2)14(26-11(5)28)9(3)13(7)25-10(4)27)15(29)33-16(17(19,20)21,18(22,23)24)6-34(30,31)32;1-7-8(2)10(4)12(11(5)9(7)3)13(23)27-14(15(17,18)19,16(20,21)22)6-28(24,25)26;1-7-5-11(10(4)9(3)8(7)2)12(22)26-13(14(16,17)18,15(19,20)21)6-27(23,24)25;1-7-5-8(2)10(4)11(9(7)3)12(22)26-13(14(16,17)18,15(19,20)21)6-27(23,24)25;1-7-4-8(2)9(3)10(5-7)11(21)25-12(13(15,16)17,14(18,19)20)6-26(22,23)24;1-7-3-4-8(9(5-7)24-2)10(20)25-11(12(14,15)16,13(17,18)19)6-26(21,22)23/h8H2,1-7H3,(H,32,33,34);7H2,1-6H3,(H,26,28)(H,31,32,33);6H2,1-5H3,(H,25,27)(H,26,28)(H,30,31,32);6H2,1-5H3,(H,24,25,26);2*5H,6H2,1-4H3,(H,23,24,25);4-5H,6H2,1-3H3,(H,22,23,24);3-5H,6H2,1-2H3,(H,21,22,23)/p-8
• InChIKey: TYUCDXXTPVOIHJ-UHFFFAOYSA-F
• XLogP: 25.87
• TPSA: 825.46 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 47
• Rotatable Bonds: 39
• Heavy Atoms: 239
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3700.94
LogP ≤ 5	25.87
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	47

Frequently Asked Questions

What is the IUPAC name of 2-[3-acetamido-5-[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-[3,5-bis[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-(3,5-diacetamido-2,4,6-trimethylbenzoyl)oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2-methoxy-4-methylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5,6-pentamethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,5,6-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(trifluoromethyl)-2-(2,3,5-trimethylbenzoyl)oxypropane-1-sulfonate?

The IUPAC name of 2-[3-acetamido-5-[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-[3,5-bis[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-(3,5-diacetamido-2,4,6-trimethylbenzoyl)oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2-methoxy-4-methylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5,6-pentamethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,5,6-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(trifluoromethyl)-2-(2,3,5-trimethylbenzoyl)oxypropane-1-sulfonate (CID 161024361) is 2-[3-acetamido-5-[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-[3,5-bis[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-(3,5-diacetamido-2,4,6-trimethylbenzoyl)oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2-methoxy-4-methylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5,6-pentamethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,5,6-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(trifluoromethyl)-2-(2,3,5-trimethylbenzoyl)oxypropane-1-sulfonate.

What is the SMILES notation for 2-[3-acetamido-5-[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-[3,5-bis[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-(3,5-diacetamido-2,4,6-trimethylbenzoyl)oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2-methoxy-4-methylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5,6-pentamethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,5,6-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(trifluoromethyl)-2-(2,3,5-trimethylbenzoyl)oxypropane-1-sulfonate?

The canonical SMILES for 2-[3-acetamido-5-[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-[3,5-bis[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-(3,5-diacetamido-2,4,6-trimethylbenzoyl)oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2-methoxy-4-methylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5,6-pentamethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,5,6-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(trifluoromethyl)-2-(2,3,5-trimethylbenzoyl)oxypropane-1-sulfonate is CC(=O)N(C)c1c(C)c(C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)c(C)c(N(C)C(C)=O)c1C.CC(=O)Nc1c(C)c(C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)c(C)c(N(C)C(C)=O)c1C.CC(=O)Nc1c(C)c(NC(C)=O)c(C)c(C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)c1C.COc1cc(C)ccc1C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F.Cc1c(C)c(C)c(C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)c(C)c1C.Cc1cc(C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)c(C)c(C)c1C.Cc1cc(C)c(C)c(C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)c1.Cc1cc(C)c(C)c(C(=O)OC(CS(=O)(=O)[O-])(C(F)(F)F)C(F)(F)F)c1C.

What is the InChIKey of 2-[3-acetamido-5-[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-[3,5-bis[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-(3,5-diacetamido-2,4,6-trimethylbenzoyl)oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2-methoxy-4-methylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5,6-pentamethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,5,6-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(trifluoromethyl)-2-(2,3,5-trimethylbenzoyl)oxypropane-1-sulfonate?

The InChIKey is TYUCDXXTPVOIHJ-UHFFFAOYSA-F. The full InChI is InChI=1S/C20H24F6N2O7S.C19H22F6N2O7S.C18H20F6N2O7S.C16H18F6O5S.2C15H16F6O5S.C14H14F6O5S.C13H12F6O6S/c1-9-14(10(2)16(28(7)13(5)30)11(3)15(9)27(6)12(4)29)17(31)35-18(19(21,22)23,20(24,25)26)8-36(32,33)34;1-8-13(9(2)15(27(6)12(5)29)10(3)14(8)26-11(4)28)16(30)34-17(18(20,21)22,19(23,24)25)7-35(31,32)33;1-7-12(8(2)14(26-11(5)28)9(3)13(7)25-10(4)27)15(29)33-16(17(19,20)21,18(22,23)24)6-34(30,31)32;1-7-8(2)10(4)12(11(5)9(7)3)13(23)27-14(15(17,18)19,16(20,21)22)6-28(24,25)26;1-7-5-11(10(4)9(3)8(7)2)12(22)26-13(14(16,17)18,15(19,20)21)6-27(23,24)25;1-7-5-8(2)10(4)11(9(7)3)12(22)26-13(14(16,17)18,15(19,20)21)6-27(23,24)25;1-7-4-8(2)9(3)10(5-7)11(21)25-12(13(15,16)17,14(18,19)20)6-26(22,23)24;1-7-3-4-8(9(5-7)24-2)10(20)25-11(12(14,15)16,13(17,18)19)6-26(21,22)23/h8H2,1-7H3,(H,32,33,34);7H2,1-6H3,(H,26,28)(H,31,32,33);6H2,1-5H3,(H,25,27)(H,26,28)(H,30,31,32);6H2,1-5H3,(H,24,25,26);2*5H,6H2,1-4H3,(H,23,24,25);4-5H,6H2,1-3H3,(H,22,23,24);3-5H,6H2,1-2H3,(H,21,22,23)/p-8.

What are the key properties of 2-[3-acetamido-5-[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-[3,5-bis[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-(3,5-diacetamido-2,4,6-trimethylbenzoyl)oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2-methoxy-4-methylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5,6-pentamethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,5,6-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(trifluoromethyl)-2-(2,3,5-trimethylbenzoyl)oxypropane-1-sulfonate?

2-[3-acetamido-5-[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-[3,5-bis[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-(3,5-diacetamido-2,4,6-trimethylbenzoyl)oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2-methoxy-4-methylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5,6-pentamethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,5,6-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(trifluoromethyl)-2-(2,3,5-trimethylbenzoyl)oxypropane-1-sulfonate has a molecular weight of 3700.94 g/mol, XLogP of 25.87, 39 rotatable bonds, 3 hydrogen bond donors, and 47 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-acetamido-5-[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-[3,5-bis[acetyl(methyl)amino]-2,4,6-trimethylbenzoyl]oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;2-(3,5-diacetamido-2,4,6-trimethylbenzoyl)oxy-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2-methoxy-4-methylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5,6-pentamethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,4,5-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(2,3,5,6-tetramethylbenzoyl)oxy-2-(trifluoromethyl)propane-1-sulfonate;3,3,3-trifluoro-2-(trifluoromethyl)-2-(2,3,5-trimethylbenzoyl)oxypropane-1-sulfonate is sourced from PubChem (CID 161024361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).