About 2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-1,1-difluoropropane-1-sulfonate;2-(2-carboxycyclohexanecarbonyl)oxy-1,1-difluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoropropane-1-sulfonate;1,1-difluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)propane-1-sulfonate;1,1-difluoro-2-(4-oxocyclohexanecarbonyl)oxypropane-1-sulfonate;1,1-difluoro-2-(5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxypropane-1-sulfonate;1,1-difluoro-2-(5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxypropane-1-sulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoropropane-1-sulfonate
2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-1,1-difluoropropane-1-sulfonate;2-(2-carboxycyclohexanecarbonyl)oxy-1,1-difluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoropropane-1-sulfonate;1,1-difluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)propane-1-sulfonate;1,1-difluoro-2-(4-oxocyclohexanecarbonyl)oxypropane-1-sulfonate;1,1-difluoro-2-(5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxypropane-1-sulfonate;1,1-difluoro-2-(5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxypropane-1-sulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoropropane-1-sulfonate (PubChem CID 159356629) has the molecular formula C83H108F16O49S8-8
and a molecular weight of 2450.23 g/mol. Its IUPAC name is 2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-1,1-difluoropropane-1-sulfonate;2-(2-carboxycyclohexanecarbonyl)oxy-1,1-difluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoropropane-1-sulfonate;1,1-difluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)propane-1-sulfonate;1,1-difluoro-2-(4-oxocyclohexanecarbonyl)oxypropane-1-sulfonate;1,1-difluoro-2-(5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxypropane-1-sulfonate;1,1-difluoro-2-(5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxypropane-1-sulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoropropane-1-sulfonate.
Frequently Asked Questions
What is the IUPAC name of 2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-1,1-difluoropropane-1-sulfonate;2-(2-carboxycyclohexanecarbonyl)oxy-1,1-difluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoropropane-1-sulfonate;1,1-difluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)propane-1-sulfonate;1,1-difluoro-2-(4-oxocyclohexanecarbonyl)oxypropane-1-sulfonate;1,1-difluoro-2-(5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxypropane-1-sulfonate;1,1-difluoro-2-(5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxypropane-1-sulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoropropane-1-sulfonate?
The IUPAC name of 2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-1,1-difluoropropane-1-sulfonate;2-(2-carboxycyclohexanecarbonyl)oxy-1,1-difluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoropropane-1-sulfonate;1,1-difluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)propane-1-sulfonate;1,1-difluoro-2-(4-oxocyclohexanecarbonyl)oxypropane-1-sulfonate;1,1-difluoro-2-(5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxypropane-1-sulfonate;1,1-difluoro-2-(5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxypropane-1-sulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoropropane-1-sulfonate (CID 159356629) is 2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-1,1-difluoropropane-1-sulfonate;2-(2-carboxycyclohexanecarbonyl)oxy-1,1-difluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoropropane-1-sulfonate;1,1-difluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)propane-1-sulfonate;1,1-difluoro-2-(4-oxocyclohexanecarbonyl)oxypropane-1-sulfonate;1,1-difluoro-2-(5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxypropane-1-sulfonate;1,1-difluoro-2-(5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxypropane-1-sulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoropropane-1-sulfonate.
What is the SMILES notation for 2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-1,1-difluoropropane-1-sulfonate;2-(2-carboxycyclohexanecarbonyl)oxy-1,1-difluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoropropane-1-sulfonate;1,1-difluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)propane-1-sulfonate;1,1-difluoro-2-(4-oxocyclohexanecarbonyl)oxypropane-1-sulfonate;1,1-difluoro-2-(5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxypropane-1-sulfonate;1,1-difluoro-2-(5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxypropane-1-sulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoropropane-1-sulfonate?
The canonical SMILES for 2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-1,1-difluoropropane-1-sulfonate;2-(2-carboxycyclohexanecarbonyl)oxy-1,1-difluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoropropane-1-sulfonate;1,1-difluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)propane-1-sulfonate;1,1-difluoro-2-(4-oxocyclohexanecarbonyl)oxypropane-1-sulfonate;1,1-difluoro-2-(5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxypropane-1-sulfonate;1,1-difluoro-2-(5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxypropane-1-sulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoropropane-1-sulfonate is CC(OC(=O)C(C)(C)C)C(F)(F)S(=O)(=O)[O-].CC(OC(=O)C1C2CC3OC(=O)C1C3C2)C(F)(F)S(=O)(=O)[O-].CC(OC(=O)C1C2CC3OC(=O)C1C3O2)C(F)(F)S(=O)(=O)[O-].CC(OC(=O)C1CC2CCC1C2)C(F)(F)S(=O)(=O)[O-].CC(OC(=O)C1CC2CCC1O2)C(F)(F)S(=O)(=O)[O-].CC(OC(=O)C1CCC(=O)CC1)C(F)(F)S(=O)(=O)[O-].CC(OC(=O)C1CCCCC1)C(F)(F)S(=O)(=O)[O-].CC(OC(=O)C1CCCCC1C(=O)O)C(F)(F)S(=O)(=O)[O-].
What is the InChIKey of 2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-1,1-difluoropropane-1-sulfonate;2-(2-carboxycyclohexanecarbonyl)oxy-1,1-difluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoropropane-1-sulfonate;1,1-difluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)propane-1-sulfonate;1,1-difluoro-2-(4-oxocyclohexanecarbonyl)oxypropane-1-sulfonate;1,1-difluoro-2-(5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxypropane-1-sulfonate;1,1-difluoro-2-(5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxypropane-1-sulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoropropane-1-sulfonate?
The InChIKey is LHZTWYWXSAKLJQ-UHFFFAOYSA-F. The full InChI is InChI=1S/C12H14F2O7S.C11H12F2O8S.C11H16F2O7S.C11H16F2O5S.2C10H14F2O6S.C10H16F2O5S.C8H14F2O5S/c1-4(12(13,14)22(17,18)19)20-10(15)8-5-2-6-7(3-5)21-11(16)9(6)8;1-3(11(12,13)22(16,17)18)19-9(14)6-4-2-5-8(20-4)7(6)10(15)21-5;1-6(11(12,13)21(17,18)19)20-10(16)8-5-3-2-4-7(8)9(14)15;1-6(11(12,13)19(15,16)17)18-10(14)9-5-7-2-3-8(9)4-7;1-5(10(11,12)19(14,15)16)17-9(13)7-4-6-2-3-8(7)18-6;1-6(10(11,12)19(15,16)17)18-9(14)7-2-4-8(13)5-3-7;1-7(10(11,12)18(14,15)16)17-9(13)8-5-3-2-4-6-8;1-5(8(9,10)16(12,13)14)15-6(11)7(2,3)4/h4-9H,2-3H2,1H3,(H,17,18,19);3-8H,2H2,1H3,(H,16,17,18);6-8H,2-5H2,1H3,(H,14,15)(H,17,18,19);6-9H,2-5H2,1H3,(H,15,16,17);5-8H,2-4H2,1H3,(H,14,15,16);6-7H,2-5H2,1H3,(H,15,16,17);7-8H,2-6H2,1H3,(H,14,15,16);5H,1-4H3,(H,12,13,14)/p-8.
What are the key properties of 2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-1,1-difluoropropane-1-sulfonate;2-(2-carboxycyclohexanecarbonyl)oxy-1,1-difluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoropropane-1-sulfonate;1,1-difluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)propane-1-sulfonate;1,1-difluoro-2-(4-oxocyclohexanecarbonyl)oxypropane-1-sulfonate;1,1-difluoro-2-(5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxypropane-1-sulfonate;1,1-difluoro-2-(5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxypropane-1-sulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoropropane-1-sulfonate?
2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-1,1-difluoropropane-1-sulfonate;2-(2-carboxycyclohexanecarbonyl)oxy-1,1-difluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoropropane-1-sulfonate;1,1-difluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)propane-1-sulfonate;1,1-difluoro-2-(4-oxocyclohexanecarbonyl)oxypropane-1-sulfonate;1,1-difluoro-2-(5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxypropane-1-sulfonate;1,1-difluoro-2-(5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxypropane-1-sulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoropropane-1-sulfonate has a molecular weight of 2450.23 g/mol, XLogP of 6.26, 32 rotatable bonds, 1 hydrogen bond donors, and 48 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(bicyclo[2.2.1]heptane-2-carbonyloxy)-1,1-difluoropropane-1-sulfonate;2-(2-carboxycyclohexanecarbonyl)oxy-1,1-difluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoropropane-1-sulfonate;1,1-difluoro-2-(7-oxabicyclo[2.2.1]heptane-2-carbonyloxy)propane-1-sulfonate;1,1-difluoro-2-(4-oxocyclohexanecarbonyl)oxypropane-1-sulfonate;1,1-difluoro-2-(5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxypropane-1-sulfonate;1,1-difluoro-2-(5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxypropane-1-sulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoropropane-1-sulfonate is sourced from PubChem (CID 159356629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).