ethyl (2S)-2-(6-bromo-1-hydroxy-3-methylnaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-(6-bromo-3-methyl-1-triethylsilyloxynaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-bromo-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-1-hydroxy-3-methylnaphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate

C113H137Br3F6O24S2Si — CID 158737986

IUPACethyl (2S)-2-(6-bromo-1-hydroxy-3-methylnaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-(6-bromo-3-methyl-1-triethylsilyloxynaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-bromo-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-1-hydroxy-3-methylnaphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate
SMILESCCOC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2cc(Br)ccc2c1O.CCOC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2cc(Br)ccc2c1OS(=O)(=O)C(F)(F)F.CCOC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2cc(Br)ccc2c1O[Si](CC)(CC)CC.CCOC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2cc(C#CC3CC3)ccc2c1O.CCOC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2cc(C#CC3CC3)ccc2c1OS(=O)(=O)C(F)(F)F
InChIInChI=1S/C25H37BrO4Si.C25H27F3O6S.C24H28O4.C20H22BrF3O6S.C19H23BrO4/c1-9-28-24(27)23(29-25(6,7)8)21-17(5)15-18-16-19(26)13-14-20(18)22(21)30-31(10-2,11-3)12-4;1-6-32-23(29)22(33-24(3,4)5)20-15(2)13-18-14-17(10-9-16-7-8-16)11-12-19(18)21(20)34-35(30,31)25(26,27)28;1-6-27-23(26)22(28-24(3,4)5)20-15(2)13-18-14-17(10-9-16-7-8-16)11-12-19(18)21(20)25;1-6-28-18(25)17(29-19(3,4)5)15-11(2)9-12-10-13(21)7-8-14(12)16(15)30-31(26,27)20(22,23)24;1-6-23-18(22)17(24-19(3,4)5)15-11(2)9-12-10-13(20)7-8-14(12)16(15)21/h13-16,23H,9-12H2,1-8H3;11-14,16,22H,6-8H2,1-5H3;11-14,16,22,25H,6-8H2,1-5H3;7-10,17H,6H2,1-5H3;7-10,17,21H,6H2,1-5H3/t23-;2*22-;2*17-/m00000/s1
InChIKeyILXQIYBEYZMAQV-LRAPTGABSA-N
MW2325.23 g/mol
LogP28.90
Rot. Bonds29

About ethyl (2S)-2-(6-bromo-1-hydroxy-3-methylnaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-(6-bromo-3-methyl-1-triethylsilyloxynaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-bromo-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-1-hydroxy-3-methylnaphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate

ethyl (2S)-2-(6-bromo-1-hydroxy-3-methylnaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-(6-bromo-3-methyl-1-triethylsilyloxynaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-bromo-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-1-hydroxy-3-methylnaphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate (PubChem CID 158737986) has the molecular formula C113H137Br3F6O24S2Si and a molecular weight of 2325.23 g/mol. Its IUPAC name is ethyl (2S)-2-(6-bromo-1-hydroxy-3-methylnaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-(6-bromo-3-methyl-1-triethylsilyloxynaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-bromo-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-1-hydroxy-3-methylnaphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate.

Molecular Properties

Compound Nameethyl (2S)-2-(6-bromo-1-hydroxy-3-methylnaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-(6-bromo-3-methyl-1-triethylsilyloxynaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-bromo-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-1-hydroxy-3-methylnaphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate
PubChem CID158737986
Molecular FormulaC113H137Br3F6O24S2Si
Molecular Weight2325.23 g/mol
Exact Mass2320.62
IUPAC Nameethyl (2S)-2-(6-bromo-1-hydroxy-3-methylnaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-(6-bromo-3-methyl-1-triethylsilyloxynaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-bromo-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-1-hydroxy-3-methylnaphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate
SMILESCCOC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2cc(Br)ccc2c1O.CCOC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2cc(Br)ccc2c1OS(=O)(=O)C(F)(F)F.CCOC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2cc(Br)ccc2c1O[Si](CC)(CC)CC.CCOC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2cc(C#CC3CC3)ccc2c1O.CCOC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2cc(C#CC3CC3)ccc2c1OS(=O)(=O)C(F)(F)F
InChIInChI=1S/C25H37BrO4Si.C25H27F3O6S.C24H28O4.C20H22BrF3O6S.C19H23BrO4/c1-9-28-24(27)23(29-25(6,7)8)21-17(5)15-18-16-19(26)13-14-20(18)22(21)30-31(10-2,11-3)12-4;1-6-32-23(29)22(33-24(3,4)5)20-15(2)13-18-14-17(10-9-16-7-8-16)11-12-19(18)21(20)34-35(30,31)25(26,27)28;1-6-27-23(26)22(28-24(3,4)5)20-15(2)13-18-14-17(10-9-16-7-8-16)11-12-19(18)21(20)25;1-6-28-18(25)17(29-19(3,4)5)15-11(2)9-12-10-13(21)7-8-14(12)16(15)30-31(26,27)20(22,23)24;1-6-23-18(22)17(24-19(3,4)5)15-11(2)9-12-10-13(20)7-8-14(12)16(15)21/h13-16,23H,9-12H2,1-8H3;11-14,16,22H,6-8H2,1-5H3;11-14,16,22,25H,6-8H2,1-5H3;7-10,17H,6H2,1-5H3;7-10,17,21H,6H2,1-5H3/t23-;2*22-;2*17-/m00000/s1
InChIKeyILXQIYBEYZMAQV-LRAPTGABSA-N
XLogP28.90
TPSA314.08 Ų
H-Bond Donors2
H-Bond Acceptors24
Rotatable Bonds29
Heavy Atoms149
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002325.23
LogP ≤ 528.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1024

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_1', 'substructure': 'N/A'}, {'alert_name': 'triflate', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze ethyl (2S)-2-(6-bromo-1-hydroxy-3-methylnaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-(6-bromo-3-methyl-1-triethylsilyloxynaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-bromo-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-1-hydroxy-3-methylnaphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate with MolForge

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Related Compounds

7-Bromo-3-methylnaphthalen-1-ol;1-(4-bromophenyl)propan-2-one;ethyl 4-(4-bromophenyl)-3-methylbut-2-enoate;ethyl 2-hydroxy-2-(1-hydroxy-3-methylnaphthalen-2-yl)acetate;ethyl 2-(1-hydroxy-3-methylnaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl 2-[(2-methylpropan-2-yl)oxy]-2-[3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]acetate;3-methylnaphthalen-1-ol
CID 157284684
6-bromo-3-methylnaphthalen-1-ol;1-(3-bromophenyl)propan-2-one;ethyl 2-(6-bromo-1-hydroxy-3-methylnaphthalen-2-yl)-2-hydroxyacetate;ethyl (2S)-2-[6-bromo-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-hydroxyacetate;ethyl 2-[6-bromo-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-hydroxyacetate;ethyl 2-[6-bromo-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-oxoacetate;ethyl 4-(3-bromophenyl)-3-methylbut-2-enoate
CID 157396160
ethyl (2S)-2-(5-bromo-1-hydroxy-3-methylnaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-(5-bromo-3-methyl-1-methylsulfonyloxynaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[5-bromo-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-(3,5-dimethyl-1-methylsulfonyloxynaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-(1-hydroxy-3,5-dimethylnaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate
CID 162193613
ethyl (2S)-2-[6-bromo-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate
CID 161441508

Frequently Asked Questions

What is the IUPAC name of ethyl (2S)-2-(6-bromo-1-hydroxy-3-methylnaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-(6-bromo-3-methyl-1-triethylsilyloxynaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-bromo-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-1-hydroxy-3-methylnaphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate?
The IUPAC name of ethyl (2S)-2-(6-bromo-1-hydroxy-3-methylnaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-(6-bromo-3-methyl-1-triethylsilyloxynaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-bromo-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-1-hydroxy-3-methylnaphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate (CID 158737986) is ethyl (2S)-2-(6-bromo-1-hydroxy-3-methylnaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-(6-bromo-3-methyl-1-triethylsilyloxynaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-bromo-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-1-hydroxy-3-methylnaphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate.
What is the SMILES notation for ethyl (2S)-2-(6-bromo-1-hydroxy-3-methylnaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-(6-bromo-3-methyl-1-triethylsilyloxynaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-bromo-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-1-hydroxy-3-methylnaphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate?
The canonical SMILES for ethyl (2S)-2-(6-bromo-1-hydroxy-3-methylnaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-(6-bromo-3-methyl-1-triethylsilyloxynaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-bromo-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-1-hydroxy-3-methylnaphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate is CCOC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2cc(Br)ccc2c1O.CCOC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2cc(Br)ccc2c1OS(=O)(=O)C(F)(F)F.CCOC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2cc(Br)ccc2c1O[Si](CC)(CC)CC.CCOC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2cc(C#CC3CC3)ccc2c1O.CCOC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2cc(C#CC3CC3)ccc2c1OS(=O)(=O)C(F)(F)F.
What is the InChIKey of ethyl (2S)-2-(6-bromo-1-hydroxy-3-methylnaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-(6-bromo-3-methyl-1-triethylsilyloxynaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-bromo-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-1-hydroxy-3-methylnaphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate?
The InChIKey is ILXQIYBEYZMAQV-LRAPTGABSA-N. The full InChI is InChI=1S/C25H37BrO4Si.C25H27F3O6S.C24H28O4.C20H22BrF3O6S.C19H23BrO4/c1-9-28-24(27)23(29-25(6,7)8)21-17(5)15-18-16-19(26)13-14-20(18)22(21)30-31(10-2,11-3)12-4;1-6-32-23(29)22(33-24(3,4)5)20-15(2)13-18-14-17(10-9-16-7-8-16)11-12-19(18)21(20)34-35(30,31)25(26,27)28;1-6-27-23(26)22(28-24(3,4)5)20-15(2)13-18-14-17(10-9-16-7-8-16)11-12-19(18)21(20)25;1-6-28-18(25)17(29-19(3,4)5)15-11(2)9-12-10-13(21)7-8-14(12)16(15)30-31(26,27)20(22,23)24;1-6-23-18(22)17(24-19(3,4)5)15-11(2)9-12-10-13(20)7-8-14(12)16(15)21/h13-16,23H,9-12H2,1-8H3;11-14,16,22H,6-8H2,1-5H3;11-14,16,22,25H,6-8H2,1-5H3;7-10,17H,6H2,1-5H3;7-10,17,21H,6H2,1-5H3/t23-;2*22-;2*17-/m00000/s1.
What are the key properties of ethyl (2S)-2-(6-bromo-1-hydroxy-3-methylnaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-(6-bromo-3-methyl-1-triethylsilyloxynaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-bromo-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-1-hydroxy-3-methylnaphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate?
ethyl (2S)-2-(6-bromo-1-hydroxy-3-methylnaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-(6-bromo-3-methyl-1-triethylsilyloxynaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-bromo-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-1-hydroxy-3-methylnaphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate has a molecular weight of 2325.23 g/mol, XLogP of 28.90, 29 rotatable bonds, 2 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl (2S)-2-(6-bromo-1-hydroxy-3-methylnaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-(6-bromo-3-methyl-1-triethylsilyloxynaphthalen-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-bromo-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-1-hydroxy-3-methylnaphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate;ethyl (2S)-2-[6-(2-cyclopropylethynyl)-3-methyl-1-(trifluoromethylsulfonyloxy)naphthalen-2-yl]-2-[(2-methylpropan-2-yl)oxy]acetate is sourced from PubChem (CID 158737986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).