[2,5-dimethyl-2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxyhexan-3-yl] 2-methylprop-2-enoate;[5-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-methyl-3-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]hexan-2-yl] 2-methylprop-2-enoate;[4-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-4-methyl-2-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]pentyl] 2-methylprop-2-enoate;[3-methyl-2-[2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxypropan-2-yl]-3-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxybutyl] 2-methylprop-2-enoate

C99H160F30O24 — CID 159123704

About [2,5-dimethyl-2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxyhexan-3-yl] 2-methylprop-2-enoate;[5-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-methyl-3-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]hexan-2-yl] 2-methylprop-2-enoate;[4-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-4-methyl-2-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]pentyl] 2-methylprop-2-enoate;[3-methyl-2-[2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxypropan-2-yl]-3-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxybutyl] 2-methylprop-2-enoate

[2,5-dimethyl-2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxyhexan-3-yl] 2-methylprop-2-enoate;[5-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-methyl-3-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]hexan-2-yl] 2-methylprop-2-enoate;[4-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-4-methyl-2-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]pentyl] 2-methylprop-2-enoate;[3-methyl-2-[2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxypropan-2-yl]-3-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxybutyl] 2-methylprop-2-enoate (PubChem CID 159123704) has the molecular formula C99H160F30O24 and a molecular weight of 2304.28 g/mol. Its IUPAC name is [2,5-dimethyl-2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxyhexan-3-yl] 2-methylprop-2-enoate;[5-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-methyl-3-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]hexan-2-yl] 2-methylprop-2-enoate;[4-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-4-methyl-2-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]pentyl] 2-methylprop-2-enoate;[3-methyl-2-[2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxypropan-2-yl]-3-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxybutyl] 2-methylprop-2-enoate.

Molecular Properties

• Compound Name: [2,5-dimethyl-2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxyhexan-3-yl] 2-methylprop-2-enoate;[5-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-methyl-3-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]hexan-2-yl] 2-methylprop-2-enoate;[4-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-4-methyl-2-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]pentyl] 2-methylprop-2-enoate;[3-methyl-2-[2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxypropan-2-yl]-3-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxybutyl] 2-methylprop-2-enoate
• PubChem CID: 159123704
• Molecular Formula: C99H160F30O24
• Molecular Weight: 2304.28 g/mol
• Exact Mass: 2303.08
• IUPAC Name: [2,5-dimethyl-2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxyhexan-3-yl] 2-methylprop-2-enoate;[5-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-methyl-3-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]hexan-2-yl] 2-methylprop-2-enoate;[4-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-4-methyl-2-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]pentyl] 2-methylprop-2-enoate;[3-methyl-2-[2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxypropan-2-yl]-3-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxybutyl] 2-methylprop-2-enoate
• SMILES: C=C(C)C(=O)OC(C)C(CC(C)(C)OC(C)(C)C(C)(C)O)C(C)(C)OC(C)(C)C(O)(C(F)(F)F)C(F)(F)F.C=C(C)C(=O)OC(CC(C)(C)OC(C)(C)C(O)(C(F)(F)F)C(F)(F)F)C(C)(C)OC(C)(C)C(C)(O)C(F)(F)F.C=C(C)C(=O)OCC(C(C)(C)OC(C)(C)C(C)(O)C(F)(F)F)C(C)(C)OC(C)(C)C(O)(C(F)(F)F)C(F)(F)F.C=C(C)C(=O)OCC(CC(C)(C)OC(C)(C)C(C)(C)O)C(C)(C)OC(C)(C)C(O)(C(F)(F)F)C(F)(F)F
• InChI: InChI=1S/C26H44F6O6.C25H42F6O6.2C24H37F9O6/c1-15(2)18(33)36-16(3)17(14-19(4,5)37-22(10,11)21(8,9)34)20(6,7)38-23(12,13)24(35,25(27,28)29)26(30,31)32;1-15(2)17(32)35-14-16(13-18(3,4)36-21(9,10)20(7,8)33)19(5,6)37-22(11,12)23(34,24(26,27)28)25(29,30)31;1-13(2)15(34)37-12-14(16(3,4)38-18(7,8)20(11,35)22(25,26)27)17(5,6)39-19(9,10)21(36,23(28,29)30)24(31,32)33;1-13(2)15(34)37-14(17(5,6)39-18(7,8)20(11,35)22(25,26)27)12-16(3,4)38-19(9,10)21(36,23(28,29)30)24(31,32)33/h16-17,34-35H,1,14H2,2-13H3;16,33-34H,1,13-14H2,2-12H3;2*14,35-36H,1,12H2,2-11H3
• InChIKey: KGADFDWQCZESIX-UHFFFAOYSA-N
• XLogP: 24.38
• TPSA: 340.88 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 24
• Rotatable Bonds: 46
• Heavy Atoms: 153
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2304.28
LogP ≤ 5	24.38
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [2,5-dimethyl-2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxyhexan-3-yl] 2-methylprop-2-enoate;[5-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-methyl-3-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]hexan-2-yl] 2-methylprop-2-enoate;[4-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-4-methyl-2-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]pentyl] 2-methylprop-2-enoate;[3-methyl-2-[2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxypropan-2-yl]-3-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxybutyl] 2-methylprop-2-enoate?

The IUPAC name of [2,5-dimethyl-2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxyhexan-3-yl] 2-methylprop-2-enoate;[5-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-methyl-3-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]hexan-2-yl] 2-methylprop-2-enoate;[4-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-4-methyl-2-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]pentyl] 2-methylprop-2-enoate;[3-methyl-2-[2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxypropan-2-yl]-3-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxybutyl] 2-methylprop-2-enoate (CID 159123704) is [2,5-dimethyl-2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxyhexan-3-yl] 2-methylprop-2-enoate;[5-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-methyl-3-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]hexan-2-yl] 2-methylprop-2-enoate;[4-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-4-methyl-2-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]pentyl] 2-methylprop-2-enoate;[3-methyl-2-[2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxypropan-2-yl]-3-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxybutyl] 2-methylprop-2-enoate.

What is the SMILES notation for [2,5-dimethyl-2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxyhexan-3-yl] 2-methylprop-2-enoate;[5-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-methyl-3-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]hexan-2-yl] 2-methylprop-2-enoate;[4-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-4-methyl-2-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]pentyl] 2-methylprop-2-enoate;[3-methyl-2-[2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxypropan-2-yl]-3-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxybutyl] 2-methylprop-2-enoate?

The canonical SMILES for [2,5-dimethyl-2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxyhexan-3-yl] 2-methylprop-2-enoate;[5-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-methyl-3-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]hexan-2-yl] 2-methylprop-2-enoate;[4-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-4-methyl-2-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]pentyl] 2-methylprop-2-enoate;[3-methyl-2-[2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxypropan-2-yl]-3-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxybutyl] 2-methylprop-2-enoate is C=C(C)C(=O)OC(C)C(CC(C)(C)OC(C)(C)C(C)(C)O)C(C)(C)OC(C)(C)C(O)(C(F)(F)F)C(F)(F)F.C=C(C)C(=O)OC(CC(C)(C)OC(C)(C)C(O)(C(F)(F)F)C(F)(F)F)C(C)(C)OC(C)(C)C(C)(O)C(F)(F)F.C=C(C)C(=O)OCC(C(C)(C)OC(C)(C)C(C)(O)C(F)(F)F)C(C)(C)OC(C)(C)C(O)(C(F)(F)F)C(F)(F)F.C=C(C)C(=O)OCC(CC(C)(C)OC(C)(C)C(C)(C)O)C(C)(C)OC(C)(C)C(O)(C(F)(F)F)C(F)(F)F.

What is the InChIKey of [2,5-dimethyl-2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxyhexan-3-yl] 2-methylprop-2-enoate;[5-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-methyl-3-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]hexan-2-yl] 2-methylprop-2-enoate;[4-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-4-methyl-2-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]pentyl] 2-methylprop-2-enoate;[3-methyl-2-[2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxypropan-2-yl]-3-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxybutyl] 2-methylprop-2-enoate?

The InChIKey is KGADFDWQCZESIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H44F6O6.C25H42F6O6.2C24H37F9O6/c1-15(2)18(33)36-16(3)17(14-19(4,5)37-22(10,11)21(8,9)34)20(6,7)38-23(12,13)24(35,25(27,28)29)26(30,31)32;1-15(2)17(32)35-14-16(13-18(3,4)36-21(9,10)20(7,8)33)19(5,6)37-22(11,12)23(34,24(26,27)28)25(29,30)31;1-13(2)15(34)37-12-14(16(3,4)38-18(7,8)20(11,35)22(25,26)27)17(5,6)39-19(9,10)21(36,23(28,29)30)24(31,32)33;1-13(2)15(34)37-14(17(5,6)39-18(7,8)20(11,35)22(25,26)27)12-16(3,4)38-19(9,10)21(36,23(28,29)30)24(31,32)33/h16-17,34-35H,1,14H2,2-13H3;16,33-34H,1,13-14H2,2-12H3;2*14,35-36H,1,12H2,2-11H3.

What are the key properties of [2,5-dimethyl-2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxyhexan-3-yl] 2-methylprop-2-enoate;[5-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-methyl-3-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]hexan-2-yl] 2-methylprop-2-enoate;[4-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-4-methyl-2-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]pentyl] 2-methylprop-2-enoate;[3-methyl-2-[2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxypropan-2-yl]-3-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxybutyl] 2-methylprop-2-enoate?

[2,5-dimethyl-2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxyhexan-3-yl] 2-methylprop-2-enoate;[5-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-methyl-3-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]hexan-2-yl] 2-methylprop-2-enoate;[4-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-4-methyl-2-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]pentyl] 2-methylprop-2-enoate;[3-methyl-2-[2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxypropan-2-yl]-3-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxybutyl] 2-methylprop-2-enoate has a molecular weight of 2304.28 g/mol, XLogP of 24.38, 46 rotatable bonds, 8 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for [2,5-dimethyl-2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxyhexan-3-yl] 2-methylprop-2-enoate;[5-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-5-methyl-3-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]hexan-2-yl] 2-methylprop-2-enoate;[4-(3-hydroxy-2,3-dimethylbutan-2-yl)oxy-4-methyl-2-[2-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxypropan-2-yl]pentyl] 2-methylprop-2-enoate;[3-methyl-2-[2-(4,4,4-trifluoro-3-hydroxy-2,3-dimethylbutan-2-yl)oxypropan-2-yl]-3-[4,4,4-trifluoro-3-hydroxy-2-methyl-3-(trifluoromethyl)butan-2-yl]oxybutyl] 2-methylprop-2-enoate is sourced from PubChem (CID 159123704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).