2-[2-(1-adamantyl)ethoxy]-1,1-difluoro-2-oxoethanesulfonate;2-(1-adamantyloxy)-1,1-difluoro-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)methoxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-oxo-2-[2-(4-oxo-1-adamantyl)ethoxy]ethanesulfonate;1,1-difluoro-2-oxo-2-[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethoxy]ethanesulfonate;2-[(3,5-dihydroxy-1-adamantyl)oxy]-1,1-difluoro-2-oxoethanesulfonate;octakis(triphenylsulfanium)

C245H244F16O50S16 — CID 158203968

IUPAC2-[2-(1-adamantyl)ethoxy]-1,1-difluoro-2-oxoethanesulfonate;2-(1-adamantyloxy)-1,1-difluoro-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)methoxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-oxo-2-[2-(4-oxo-1-adamantyl)ethoxy]ethanesulfonate;1,1-difluoro-2-oxo-2-[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethoxy]ethanesulfonate;2-[(3,5-dihydroxy-1-adamantyl)oxy]-1,1-difluoro-2-oxoethanesulfonate;octakis(triphenylsulfanium)
SMILESO=C(COC(=O)C(F)(F)S(=O)(=O)[O-])OC1C2CC3C(=O)OC1C3C2.O=C(OC12CC3CC(C1)C(O)C(C3)C2)C(F)(F)S(=O)(=O)[O-].O=C(OC12CC3CC(CC(C3)C1)C2)C(F)(F)S(=O)(=O)[O-].O=C(OC12CC3CC(CC(O)(C3)C1)C2)C(F)(F)S(=O)(=O)[O-].O=C(OC12CC3CC(O)(CC(O)(C3)C1)C2)C(F)(F)S(=O)(=O)[O-].O=C(OCC12CC3CC(CC(O)(C3)C1)C2)C(F)(F)S(=O)(=O)[O-].O=C(OCCC12CC3CC(CC(C3)C1)C2)C(F)(F)S(=O)(=O)[O-].O=C1C2CC3CC1CC(CCOC(=O)C(F)(F)S(=O)(=O)[O-])(C3)C2.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/8C18H15S.C14H18F2O6S.C14H20F2O5S.C13H18F2O6S.C12H12F2O9S.C12H16F2O7S.2C12H16F2O6S.C12H16F2O5S/c8*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;15-14(16,23(19,20)21)12(18)22-2-1-13-5-8-3-9(6-13)11(17)10(4-8)7-13;15-14(16,22(18,19)20)12(17)21-2-1-13-6-9-3-10(7-13)5-11(4-9)8-13;14-13(15,22(18,19)20)10(16)21-7-11-2-8-1-9(3-11)5-12(17,4-8)6-11;13-12(14,24(18,19)20)11(17)21-3-7(15)22-8-4-1-5-6(2-4)10(16)23-9(5)8;13-12(14,22(18,19)20)8(15)21-11-3-7-1-9(16,5-11)4-10(17,2-7)6-11;13-12(14,21(17,18)19)9(15)20-11-4-7-1-8(5-11)3-10(16,2-7)6-11;13-12(14,21(17,18)19)10(16)20-11-3-6-1-7(4-11)9(15)8(2-6)5-11;13-12(14,20(16,17)18)10(15)19-11-4-7-1-8(5-11)3-9(2-7)6-11/h8*1-15H;8-10H,1-7H2,(H,19,20,21);9-11H,1-8H2,(H,18,19,20);8-9,17H,1-7H2,(H,18,19,20);4-6,8-9H,1-3H2,(H,18,19,20);7,16-17H,1-6H2,(H,18,19,20);7-8,16H,1-6H2,(H,17,18,19);6-9,15H,1-5H2,(H,17,18,19);7-9H,1-6H2,(H,16,17,18)/q8*+1;;;;;;;;/p-8
InChIKeyGBGRPYRMLQBDEL-UHFFFAOYSA-F
MW4805.64 g/mol
LogP45.00
Rot. Bonds55

About 2-[2-(1-adamantyl)ethoxy]-1,1-difluoro-2-oxoethanesulfonate;2-(1-adamantyloxy)-1,1-difluoro-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)methoxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-oxo-2-[2-(4-oxo-1-adamantyl)ethoxy]ethanesulfonate;1,1-difluoro-2-oxo-2-[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethoxy]ethanesulfonate;2-[(3,5-dihydroxy-1-adamantyl)oxy]-1,1-difluoro-2-oxoethanesulfonate;octakis(triphenylsulfanium)

2-[2-(1-adamantyl)ethoxy]-1,1-difluoro-2-oxoethanesulfonate;2-(1-adamantyloxy)-1,1-difluoro-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)methoxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-oxo-2-[2-(4-oxo-1-adamantyl)ethoxy]ethanesulfonate;1,1-difluoro-2-oxo-2-[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethoxy]ethanesulfonate;2-[(3,5-dihydroxy-1-adamantyl)oxy]-1,1-difluoro-2-oxoethanesulfonate;octakis(triphenylsulfanium) (PubChem CID 158203968) has the molecular formula C245H244F16O50S16 and a molecular weight of 4805.64 g/mol. Its IUPAC name is 2-[2-(1-adamantyl)ethoxy]-1,1-difluoro-2-oxoethanesulfonate;2-(1-adamantyloxy)-1,1-difluoro-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)methoxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-oxo-2-[2-(4-oxo-1-adamantyl)ethoxy]ethanesulfonate;1,1-difluoro-2-oxo-2-[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethoxy]ethanesulfonate;2-[(3,5-dihydroxy-1-adamantyl)oxy]-1,1-difluoro-2-oxoethanesulfonate;octakis(triphenylsulfanium).

Molecular Properties

Compound Name2-[2-(1-adamantyl)ethoxy]-1,1-difluoro-2-oxoethanesulfonate;2-(1-adamantyloxy)-1,1-difluoro-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)methoxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-oxo-2-[2-(4-oxo-1-adamantyl)ethoxy]ethanesulfonate;1,1-difluoro-2-oxo-2-[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethoxy]ethanesulfonate;2-[(3,5-dihydroxy-1-adamantyl)oxy]-1,1-difluoro-2-oxoethanesulfonate;octakis(triphenylsulfanium)
PubChem CID158203968
Molecular FormulaC245H244F16O50S16
Molecular Weight4805.64 g/mol
Exact Mass4801.18
IUPAC Name2-[2-(1-adamantyl)ethoxy]-1,1-difluoro-2-oxoethanesulfonate;2-(1-adamantyloxy)-1,1-difluoro-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)methoxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-oxo-2-[2-(4-oxo-1-adamantyl)ethoxy]ethanesulfonate;1,1-difluoro-2-oxo-2-[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethoxy]ethanesulfonate;2-[(3,5-dihydroxy-1-adamantyl)oxy]-1,1-difluoro-2-oxoethanesulfonate;octakis(triphenylsulfanium)
SMILESO=C(COC(=O)C(F)(F)S(=O)(=O)[O-])OC1C2CC3C(=O)OC1C3C2.O=C(OC12CC3CC(C1)C(O)C(C3)C2)C(F)(F)S(=O)(=O)[O-].O=C(OC12CC3CC(CC(C3)C1)C2)C(F)(F)S(=O)(=O)[O-].O=C(OC12CC3CC(CC(O)(C3)C1)C2)C(F)(F)S(=O)(=O)[O-].O=C(OC12CC3CC(O)(CC(O)(C3)C1)C2)C(F)(F)S(=O)(=O)[O-].O=C(OCC12CC3CC(CC(O)(C3)C1)C2)C(F)(F)S(=O)(=O)[O-].O=C(OCCC12CC3CC(CC(C3)C1)C2)C(F)(F)S(=O)(=O)[O-].O=C1C2CC3CC1CC(CCOC(=O)C(F)(F)S(=O)(=O)[O-])(C3)C2.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/8C18H15S.C14H18F2O6S.C14H20F2O5S.C13H18F2O6S.C12H12F2O9S.C12H16F2O7S.2C12H16F2O6S.C12H16F2O5S/c8*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;15-14(16,23(19,20)21)12(18)22-2-1-13-5-8-3-9(6-13)11(17)10(4-8)7-13;15-14(16,22(18,19)20)12(17)21-2-1-13-6-9-3-10(7-13)5-11(4-9)8-13;14-13(15,22(18,19)20)10(16)21-7-11-2-8-1-9(3-11)5-12(17,4-8)6-11;13-12(14,24(18,19)20)11(17)21-3-7(15)22-8-4-1-5-6(2-4)10(16)23-9(5)8;13-12(14,22(18,19)20)8(15)21-11-3-7-1-9(16,5-11)4-10(17,2-7)6-11;13-12(14,21(17,18)19)9(15)20-11-4-7-1-8(5-11)3-10(16,2-7)6-11;13-12(14,21(17,18)19)10(16)20-11-3-6-1-7(4-11)9(15)8(2-6)5-11;13-12(14,20(16,17)18)10(15)19-11-4-7-1-8(5-11)3-9(2-7)6-11/h8*1-15H;8-10H,1-7H2,(H,19,20,21);9-11H,1-8H2,(H,18,19,20);8-9,17H,1-7H2,(H,18,19,20);4-6,8-9H,1-3H2,(H,18,19,20);7,16-17H,1-6H2,(H,18,19,20);7-8,16H,1-6H2,(H,17,18,19);6-9,15H,1-5H2,(H,17,18,19);7-9H,1-6H2,(H,16,17,18)/q8*+1;;;;;;;;/p-8
InChIKeyGBGRPYRMLQBDEL-UHFFFAOYSA-F
XLogP45.00
TPSA838.82 Ų
H-Bond Donors5
H-Bond Acceptors50
Rotatable Bonds55
Heavy Atoms327
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004805.64
LogP ≤ 545.00
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1050

Analyze 2-[2-(1-adamantyl)ethoxy]-1,1-difluoro-2-oxoethanesulfonate;2-(1-adamantyloxy)-1,1-difluoro-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)methoxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-oxo-2-[2-(4-oxo-1-adamantyl)ethoxy]ethanesulfonate;1,1-difluoro-2-oxo-2-[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethoxy]ethanesulfonate;2-[(3,5-dihydroxy-1-adamantyl)oxy]-1,1-difluoro-2-oxoethanesulfonate;octakis(triphenylsulfanium) with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(1-adamantyl)ethoxy]-1,1-difluoro-2-oxoethanesulfonate;2-(1-adamantyloxy)-1,1-difluoro-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)methoxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-oxo-2-[2-(4-oxo-1-adamantyl)ethoxy]ethanesulfonate;1,1-difluoro-2-oxo-2-[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethoxy]ethanesulfonate;2-[(3,5-dihydroxy-1-adamantyl)oxy]-1,1-difluoro-2-oxoethanesulfonate;octakis(triphenylsulfanium)?
The IUPAC name of 2-[2-(1-adamantyl)ethoxy]-1,1-difluoro-2-oxoethanesulfonate;2-(1-adamantyloxy)-1,1-difluoro-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)methoxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-oxo-2-[2-(4-oxo-1-adamantyl)ethoxy]ethanesulfonate;1,1-difluoro-2-oxo-2-[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethoxy]ethanesulfonate;2-[(3,5-dihydroxy-1-adamantyl)oxy]-1,1-difluoro-2-oxoethanesulfonate;octakis(triphenylsulfanium) (CID 158203968) is 2-[2-(1-adamantyl)ethoxy]-1,1-difluoro-2-oxoethanesulfonate;2-(1-adamantyloxy)-1,1-difluoro-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)methoxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-oxo-2-[2-(4-oxo-1-adamantyl)ethoxy]ethanesulfonate;1,1-difluoro-2-oxo-2-[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethoxy]ethanesulfonate;2-[(3,5-dihydroxy-1-adamantyl)oxy]-1,1-difluoro-2-oxoethanesulfonate;octakis(triphenylsulfanium).
What is the SMILES notation for 2-[2-(1-adamantyl)ethoxy]-1,1-difluoro-2-oxoethanesulfonate;2-(1-adamantyloxy)-1,1-difluoro-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)methoxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-oxo-2-[2-(4-oxo-1-adamantyl)ethoxy]ethanesulfonate;1,1-difluoro-2-oxo-2-[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethoxy]ethanesulfonate;2-[(3,5-dihydroxy-1-adamantyl)oxy]-1,1-difluoro-2-oxoethanesulfonate;octakis(triphenylsulfanium)?
The canonical SMILES for 2-[2-(1-adamantyl)ethoxy]-1,1-difluoro-2-oxoethanesulfonate;2-(1-adamantyloxy)-1,1-difluoro-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)methoxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-oxo-2-[2-(4-oxo-1-adamantyl)ethoxy]ethanesulfonate;1,1-difluoro-2-oxo-2-[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethoxy]ethanesulfonate;2-[(3,5-dihydroxy-1-adamantyl)oxy]-1,1-difluoro-2-oxoethanesulfonate;octakis(triphenylsulfanium) is O=C(COC(=O)C(F)(F)S(=O)(=O)[O-])OC1C2CC3C(=O)OC1C3C2.O=C(OC12CC3CC(C1)C(O)C(C3)C2)C(F)(F)S(=O)(=O)[O-].O=C(OC12CC3CC(CC(C3)C1)C2)C(F)(F)S(=O)(=O)[O-].O=C(OC12CC3CC(CC(O)(C3)C1)C2)C(F)(F)S(=O)(=O)[O-].O=C(OC12CC3CC(O)(CC(O)(C3)C1)C2)C(F)(F)S(=O)(=O)[O-].O=C(OCC12CC3CC(CC(O)(C3)C1)C2)C(F)(F)S(=O)(=O)[O-].O=C(OCCC12CC3CC(CC(C3)C1)C2)C(F)(F)S(=O)(=O)[O-].O=C1C2CC3CC1CC(CCOC(=O)C(F)(F)S(=O)(=O)[O-])(C3)C2.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 2-[2-(1-adamantyl)ethoxy]-1,1-difluoro-2-oxoethanesulfonate;2-(1-adamantyloxy)-1,1-difluoro-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)methoxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-oxo-2-[2-(4-oxo-1-adamantyl)ethoxy]ethanesulfonate;1,1-difluoro-2-oxo-2-[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethoxy]ethanesulfonate;2-[(3,5-dihydroxy-1-adamantyl)oxy]-1,1-difluoro-2-oxoethanesulfonate;octakis(triphenylsulfanium)?
The InChIKey is GBGRPYRMLQBDEL-UHFFFAOYSA-F. The full InChI is InChI=1S/8C18H15S.C14H18F2O6S.C14H20F2O5S.C13H18F2O6S.C12H12F2O9S.C12H16F2O7S.2C12H16F2O6S.C12H16F2O5S/c8*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;15-14(16,23(19,20)21)12(18)22-2-1-13-5-8-3-9(6-13)11(17)10(4-8)7-13;15-14(16,22(18,19)20)12(17)21-2-1-13-6-9-3-10(7-13)5-11(4-9)8-13;14-13(15,22(18,19)20)10(16)21-7-11-2-8-1-9(3-11)5-12(17,4-8)6-11;13-12(14,24(18,19)20)11(17)21-3-7(15)22-8-4-1-5-6(2-4)10(16)23-9(5)8;13-12(14,22(18,19)20)8(15)21-11-3-7-1-9(16,5-11)4-10(17,2-7)6-11;13-12(14,21(17,18)19)9(15)20-11-4-7-1-8(5-11)3-10(16,2-7)6-11;13-12(14,21(17,18)19)10(16)20-11-3-6-1-7(4-11)9(15)8(2-6)5-11;13-12(14,20(16,17)18)10(15)19-11-4-7-1-8(5-11)3-9(2-7)6-11/h8*1-15H;8-10H,1-7H2,(H,19,20,21);9-11H,1-8H2,(H,18,19,20);8-9,17H,1-7H2,(H,18,19,20);4-6,8-9H,1-3H2,(H,18,19,20);7,16-17H,1-6H2,(H,18,19,20);7-8,16H,1-6H2,(H,17,18,19);6-9,15H,1-5H2,(H,17,18,19);7-9H,1-6H2,(H,16,17,18)/q8*+1;;;;;;;;/p-8.
What are the key properties of 2-[2-(1-adamantyl)ethoxy]-1,1-difluoro-2-oxoethanesulfonate;2-(1-adamantyloxy)-1,1-difluoro-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)methoxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-oxo-2-[2-(4-oxo-1-adamantyl)ethoxy]ethanesulfonate;1,1-difluoro-2-oxo-2-[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethoxy]ethanesulfonate;2-[(3,5-dihydroxy-1-adamantyl)oxy]-1,1-difluoro-2-oxoethanesulfonate;octakis(triphenylsulfanium)?
2-[2-(1-adamantyl)ethoxy]-1,1-difluoro-2-oxoethanesulfonate;2-(1-adamantyloxy)-1,1-difluoro-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)methoxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-oxo-2-[2-(4-oxo-1-adamantyl)ethoxy]ethanesulfonate;1,1-difluoro-2-oxo-2-[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethoxy]ethanesulfonate;2-[(3,5-dihydroxy-1-adamantyl)oxy]-1,1-difluoro-2-oxoethanesulfonate;octakis(triphenylsulfanium) has a molecular weight of 4805.64 g/mol, XLogP of 45.00, 55 rotatable bonds, 5 hydrogen bond donors, and 50 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1-adamantyl)ethoxy]-1,1-difluoro-2-oxoethanesulfonate;2-(1-adamantyloxy)-1,1-difluoro-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)methoxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonate;1,1-difluoro-2-oxo-2-[2-(4-oxo-1-adamantyl)ethoxy]ethanesulfonate;1,1-difluoro-2-oxo-2-[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethoxy]ethanesulfonate;2-[(3,5-dihydroxy-1-adamantyl)oxy]-1,1-difluoro-2-oxoethanesulfonate;octakis(triphenylsulfanium) is sourced from PubChem (CID 158203968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).