bis((2-tert-butyl-4,6-dimethylcyclohexyl) 2,2-dimethylbutanoate);[4-tert-butyl-2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(3-tert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,6-ditert-butyl-4-methylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylphenyl) 2,2-dimethylbutanoate;[2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(2,4,6-tritert-butylcyclohexyl) 2,2-dimethylbutanoate;[4-(2,3,3-trimethylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate

C238H446O24 — CID 158915797

About bis((2-tert-butyl-4,6-dimethylcyclohexyl) 2,2-dimethylbutanoate);[4-tert-butyl-2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(3-tert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,6-ditert-butyl-4-methylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylphenyl) 2,2-dimethylbutanoate;[2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(2,4,6-tritert-butylcyclohexyl) 2,2-dimethylbutanoate;[4-(2,3,3-trimethylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate

bis((2-tert-butyl-4,6-dimethylcyclohexyl) 2,2-dimethylbutanoate);[4-tert-butyl-2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(3-tert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,6-ditert-butyl-4-methylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylphenyl) 2,2-dimethylbutanoate;[2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(2,4,6-tritert-butylcyclohexyl) 2,2-dimethylbutanoate;[4-(2,3,3-trimethylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate (PubChem CID 158915797) has the molecular formula C238H446O24 and a molecular weight of 3692.16 g/mol. Its IUPAC name is bis((2-tert-butyl-4,6-dimethylcyclohexyl) 2,2-dimethylbutanoate);[4-tert-butyl-2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(3-tert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,6-ditert-butyl-4-methylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylphenyl) 2,2-dimethylbutanoate;[2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(2,4,6-tritert-butylcyclohexyl) 2,2-dimethylbutanoate;[4-(2,3,3-trimethylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate.

Molecular Properties

• Compound Name: bis((2-tert-butyl-4,6-dimethylcyclohexyl) 2,2-dimethylbutanoate);[4-tert-butyl-2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(3-tert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,6-ditert-butyl-4-methylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylphenyl) 2,2-dimethylbutanoate;[2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(2,4,6-tritert-butylcyclohexyl) 2,2-dimethylbutanoate;[4-(2,3,3-trimethylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate
• PubChem CID: 158915797
• Molecular Formula: C238H446O24
• Molecular Weight: 3692.16 g/mol
• Exact Mass: 3689.37
• IUPAC Name: bis((2-tert-butyl-4,6-dimethylcyclohexyl) 2,2-dimethylbutanoate);[4-tert-butyl-2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(3-tert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,6-ditert-butyl-4-methylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylphenyl) 2,2-dimethylbutanoate;[2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(2,4,6-tritert-butylcyclohexyl) 2,2-dimethylbutanoate;[4-(2,3,3-trimethylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate
• SMILES: CCC(C)(C)C(=O)OC1C(C(C)(C)C)CC(C(C)(C)C)CC1C(C)(C)C.CCC(C)(C)C(=O)OC1C(C(C)(C)C)CC(C)CC1C(C)(C)C.CCC(C)(C)C(=O)OC1C(C(C)C)CC(C(C)(C)C)CC1C(C)C.CCC(C)(C)C(=O)OC1C(C(C)C)CCCC1C(C)C.CCC(C)(C)C(=O)OC1C(C)CC(C)CC1C(C)(C)C.CCC(C)(C)C(=O)OC1C(C)CC(C)CC1C(C)(C)C.CCC(C)(C)C(=O)OC1CC(C(C)(C)C)CC(C(C)(C)C)C1.CCC(C)(C)C(=O)OC1CC(C)C(C(C)(C)C)CC1C(C)(C)C.CCC(C)(C)C(=O)OC1CC(C)CC(C(C)(C)C)C1.CCC(C)(C)C(=O)OC1CCC(C(C)(C)C(C)(C)C)CC1.CCC(C)(C)C(=O)OC1CCC(C(C)(C)C)CC1C(C)(C)C.CCC(C)(C)C(=O)Oc1cc(C(C)(C)C)cc(C(C)(C)C)c1
• InChI: InChI=1S/C24H46O2.C22H42O2.2C21H40O2.C20H38O2.C20H32O2.C20H38O2.C19H36O2.3C18H34O2.C17H32O2/c1-13-24(11,12)20(25)26-19-17(22(5,6)7)14-16(21(2,3)4)15-18(19)23(8,9)10;1-11-22(9,10)20(23)24-19-17(14(2)3)12-16(21(6,7)8)13-18(19)15(4)5;1-11-21(9,10)18(22)23-17-12-14(2)15(19(3,4)5)13-16(17)20(6,7)8;1-11-21(9,10)18(22)23-17-15(19(3,4)5)12-14(2)13-16(17)20(6,7)8;2*1-10-20(8,9)17(21)22-16-12-14(18(2,3)4)11-15(13-16)19(5,6)7;1-10-20(8,9)17(21)22-16-12-11-14(18(2,3)4)13-15(16)19(5,6)7;1-9-18(5,6)16(20)21-15-12-10-14(11-13-15)19(7,8)17(2,3)4;2*1-9-18(7,8)16(19)20-15-13(3)10-12(2)11-14(15)17(4,5)6;1-8-18(6,7)17(19)20-16-14(12(2)3)10-9-11-15(16)13(4)5;1-8-17(6,7)15(18)19-14-10-12(2)9-13(11-14)16(3,4)5/h16-19H,13-15H2,1-12H3;14-19H,11-13H2,1-10H3;2*14-17H,11-13H2,1-10H3;14-16H,10-13H2,1-9H3;11-13H,10H2,1-9H3;14-16H,10-13H2,1-9H3;14-15H,9-13H2,1-8H3;2*12-15H,9-11H2,1-8H3;12-16H,8-11H2,1-7H3;12-14H,8-11H2,1-7H3
• InChIKey: JHFCHIUWQDPBSV-UHFFFAOYSA-N
• XLogP: 68.54
• TPSA: 315.60 Ų
• H-Bond Acceptors: 24
• Rotatable Bonds: 41
• Heavy Atoms: 262
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3692.16
LogP ≤ 5	68.54
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	24

Frequently Asked Questions

What is the IUPAC name of bis((2-tert-butyl-4,6-dimethylcyclohexyl) 2,2-dimethylbutanoate);[4-tert-butyl-2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(3-tert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,6-ditert-butyl-4-methylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylphenyl) 2,2-dimethylbutanoate;[2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(2,4,6-tritert-butylcyclohexyl) 2,2-dimethylbutanoate;[4-(2,3,3-trimethylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate?

The IUPAC name of bis((2-tert-butyl-4,6-dimethylcyclohexyl) 2,2-dimethylbutanoate);[4-tert-butyl-2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(3-tert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,6-ditert-butyl-4-methylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylphenyl) 2,2-dimethylbutanoate;[2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(2,4,6-tritert-butylcyclohexyl) 2,2-dimethylbutanoate;[4-(2,3,3-trimethylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate (CID 158915797) is bis((2-tert-butyl-4,6-dimethylcyclohexyl) 2,2-dimethylbutanoate);[4-tert-butyl-2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(3-tert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,6-ditert-butyl-4-methylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylphenyl) 2,2-dimethylbutanoate;[2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(2,4,6-tritert-butylcyclohexyl) 2,2-dimethylbutanoate;[4-(2,3,3-trimethylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate.

What is the SMILES notation for bis((2-tert-butyl-4,6-dimethylcyclohexyl) 2,2-dimethylbutanoate);[4-tert-butyl-2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(3-tert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,6-ditert-butyl-4-methylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylphenyl) 2,2-dimethylbutanoate;[2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(2,4,6-tritert-butylcyclohexyl) 2,2-dimethylbutanoate;[4-(2,3,3-trimethylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate?

The canonical SMILES for bis((2-tert-butyl-4,6-dimethylcyclohexyl) 2,2-dimethylbutanoate);[4-tert-butyl-2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(3-tert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,6-ditert-butyl-4-methylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylphenyl) 2,2-dimethylbutanoate;[2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(2,4,6-tritert-butylcyclohexyl) 2,2-dimethylbutanoate;[4-(2,3,3-trimethylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate is CCC(C)(C)C(=O)OC1C(C(C)(C)C)CC(C(C)(C)C)CC1C(C)(C)C.CCC(C)(C)C(=O)OC1C(C(C)(C)C)CC(C)CC1C(C)(C)C.CCC(C)(C)C(=O)OC1C(C(C)C)CC(C(C)(C)C)CC1C(C)C.CCC(C)(C)C(=O)OC1C(C(C)C)CCCC1C(C)C.CCC(C)(C)C(=O)OC1C(C)CC(C)CC1C(C)(C)C.CCC(C)(C)C(=O)OC1C(C)CC(C)CC1C(C)(C)C.CCC(C)(C)C(=O)OC1CC(C(C)(C)C)CC(C(C)(C)C)C1.CCC(C)(C)C(=O)OC1CC(C)C(C(C)(C)C)CC1C(C)(C)C.CCC(C)(C)C(=O)OC1CC(C)CC(C(C)(C)C)C1.CCC(C)(C)C(=O)OC1CCC(C(C)(C)C(C)(C)C)CC1.CCC(C)(C)C(=O)OC1CCC(C(C)(C)C)CC1C(C)(C)C.CCC(C)(C)C(=O)Oc1cc(C(C)(C)C)cc(C(C)(C)C)c1.

What is the InChIKey of bis((2-tert-butyl-4,6-dimethylcyclohexyl) 2,2-dimethylbutanoate);[4-tert-butyl-2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(3-tert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,6-ditert-butyl-4-methylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylphenyl) 2,2-dimethylbutanoate;[2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(2,4,6-tritert-butylcyclohexyl) 2,2-dimethylbutanoate;[4-(2,3,3-trimethylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate?

The InChIKey is JHFCHIUWQDPBSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H46O2.C22H42O2.2C21H40O2.C20H38O2.C20H32O2.C20H38O2.C19H36O2.3C18H34O2.C17H32O2/c1-13-24(11,12)20(25)26-19-17(22(5,6)7)14-16(21(2,3)4)15-18(19)23(8,9)10;1-11-22(9,10)20(23)24-19-17(14(2)3)12-16(21(6,7)8)13-18(19)15(4)5;1-11-21(9,10)18(22)23-17-12-14(2)15(19(3,4)5)13-16(17)20(6,7)8;1-11-21(9,10)18(22)23-17-15(19(3,4)5)12-14(2)13-16(17)20(6,7)8;2*1-10-20(8,9)17(21)22-16-12-14(18(2,3)4)11-15(13-16)19(5,6)7;1-10-20(8,9)17(21)22-16-12-11-14(18(2,3)4)13-15(16)19(5,6)7;1-9-18(5,6)16(20)21-15-12-10-14(11-13-15)19(7,8)17(2,3)4;2*1-9-18(7,8)16(19)20-15-13(3)10-12(2)11-14(15)17(4,5)6;1-8-18(6,7)17(19)20-16-14(12(2)3)10-9-11-15(16)13(4)5;1-8-17(6,7)15(18)19-14-10-12(2)9-13(11-14)16(3,4)5/h16-19H,13-15H2,1-12H3;14-19H,11-13H2,1-10H3;2*14-17H,11-13H2,1-10H3;14-16H,10-13H2,1-9H3;11-13H,10H2,1-9H3;14-16H,10-13H2,1-9H3;14-15H,9-13H2,1-8H3;2*12-15H,9-11H2,1-8H3;12-16H,8-11H2,1-7H3;12-14H,8-11H2,1-7H3.

What are the key properties of bis((2-tert-butyl-4,6-dimethylcyclohexyl) 2,2-dimethylbutanoate);[4-tert-butyl-2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(3-tert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,6-ditert-butyl-4-methylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylphenyl) 2,2-dimethylbutanoate;[2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(2,4,6-tritert-butylcyclohexyl) 2,2-dimethylbutanoate;[4-(2,3,3-trimethylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate?

bis((2-tert-butyl-4,6-dimethylcyclohexyl) 2,2-dimethylbutanoate);[4-tert-butyl-2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(3-tert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,6-ditert-butyl-4-methylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylphenyl) 2,2-dimethylbutanoate;[2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(2,4,6-tritert-butylcyclohexyl) 2,2-dimethylbutanoate;[4-(2,3,3-trimethylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate has a molecular weight of 3692.16 g/mol, XLogP of 68.54, 41 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for bis((2-tert-butyl-4,6-dimethylcyclohexyl) 2,2-dimethylbutanoate);[4-tert-butyl-2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(3-tert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylcyclohexyl) 2,2-dimethylbutanoate;(2,4-ditert-butyl-5-methylcyclohexyl) 2,2-dimethylbutanoate;(2,6-ditert-butyl-4-methylcyclohexyl) 2,2-dimethylbutanoate;(3,5-ditert-butylphenyl) 2,2-dimethylbutanoate;[2,6-di(propan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(2,4,6-tritert-butylcyclohexyl) 2,2-dimethylbutanoate;[4-(2,3,3-trimethylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate is sourced from PubChem (CID 158915797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).