(1-tert-butylcyclohexyl) 2,2-dimethylbutanoate;(1-butylcyclopentyl) 2,2-dimethylbutanoate;(1-ethylcycloheptyl) 2,2-dimethylbutanoate;(1-ethylcyclohexyl) 2,2-dimethylbutanoate;(1-ethylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(1-methylcyclodecyl) 2,2-dimethylbutanoate;(1-methylcycloheptyl) 2,2-dimethylbutanoate;(1-methylcyclohexyl) 2,2-dimethylbutanoate;(1-methylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylpropyl)cyclopentyl] 2,2-dimethylbutanoate;(1-propan-2-ylcyclohexyl) 2,2-dimethylbutanoate

C182H340O24 — CID 157335066

About (1-tert-butylcyclohexyl) 2,2-dimethylbutanoate;(1-butylcyclopentyl) 2,2-dimethylbutanoate;(1-ethylcycloheptyl) 2,2-dimethylbutanoate;(1-ethylcyclohexyl) 2,2-dimethylbutanoate;(1-ethylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(1-methylcyclodecyl) 2,2-dimethylbutanoate;(1-methylcycloheptyl) 2,2-dimethylbutanoate;(1-methylcyclohexyl) 2,2-dimethylbutanoate;(1-methylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylpropyl)cyclopentyl] 2,2-dimethylbutanoate;(1-propan-2-ylcyclohexyl) 2,2-dimethylbutanoate

(1-tert-butylcyclohexyl) 2,2-dimethylbutanoate;(1-butylcyclopentyl) 2,2-dimethylbutanoate;(1-ethylcycloheptyl) 2,2-dimethylbutanoate;(1-ethylcyclohexyl) 2,2-dimethylbutanoate;(1-ethylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(1-methylcyclodecyl) 2,2-dimethylbutanoate;(1-methylcycloheptyl) 2,2-dimethylbutanoate;(1-methylcyclohexyl) 2,2-dimethylbutanoate;(1-methylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylpropyl)cyclopentyl] 2,2-dimethylbutanoate;(1-propan-2-ylcyclohexyl) 2,2-dimethylbutanoate (PubChem CID 157335066) has the molecular formula C182H340O24 and a molecular weight of 2912.70 g/mol. Its IUPAC name is (1-tert-butylcyclohexyl) 2,2-dimethylbutanoate;(1-butylcyclopentyl) 2,2-dimethylbutanoate;(1-ethylcycloheptyl) 2,2-dimethylbutanoate;(1-ethylcyclohexyl) 2,2-dimethylbutanoate;(1-ethylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(1-methylcyclodecyl) 2,2-dimethylbutanoate;(1-methylcycloheptyl) 2,2-dimethylbutanoate;(1-methylcyclohexyl) 2,2-dimethylbutanoate;(1-methylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylpropyl)cyclopentyl] 2,2-dimethylbutanoate;(1-propan-2-ylcyclohexyl) 2,2-dimethylbutanoate.

Molecular Properties

• Compound Name: (1-tert-butylcyclohexyl) 2,2-dimethylbutanoate;(1-butylcyclopentyl) 2,2-dimethylbutanoate;(1-ethylcycloheptyl) 2,2-dimethylbutanoate;(1-ethylcyclohexyl) 2,2-dimethylbutanoate;(1-ethylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(1-methylcyclodecyl) 2,2-dimethylbutanoate;(1-methylcycloheptyl) 2,2-dimethylbutanoate;(1-methylcyclohexyl) 2,2-dimethylbutanoate;(1-methylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylpropyl)cyclopentyl] 2,2-dimethylbutanoate;(1-propan-2-ylcyclohexyl) 2,2-dimethylbutanoate
• PubChem CID: 157335066
• Molecular Formula: C182H340O24
• Molecular Weight: 2912.70 g/mol
• Exact Mass: 2910.54
• IUPAC Name: (1-tert-butylcyclohexyl) 2,2-dimethylbutanoate;(1-butylcyclopentyl) 2,2-dimethylbutanoate;(1-ethylcycloheptyl) 2,2-dimethylbutanoate;(1-ethylcyclohexyl) 2,2-dimethylbutanoate;(1-ethylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(1-methylcyclodecyl) 2,2-dimethylbutanoate;(1-methylcycloheptyl) 2,2-dimethylbutanoate;(1-methylcyclohexyl) 2,2-dimethylbutanoate;(1-methylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylpropyl)cyclopentyl] 2,2-dimethylbutanoate;(1-propan-2-ylcyclohexyl) 2,2-dimethylbutanoate
• SMILES: CCC(C)(C)C(=O)OC1(C(C)(C)C)CCCCC1.CCC(C)(C)C(=O)OC1(C(C)(C)CC)CCCCC1.CCC(C)(C)C(=O)OC1(C(C)C)CCCCC1.CCC(C)(C)C(=O)OC1(C)CCCCC1.CCC(C)(C)C(=O)OC1(C)CCCCCC1.CCC(C)(C)C(=O)OC1(C)CCCCCCC1.CCC(C)(C)C(=O)OC1(C)CCCCCCCCC1.CCC(C)(C)C(=O)OC1(CC(C)C)CCCC1.CCC1(OC(=O)C(C)(C)CC)CCCCC1.CCC1(OC(=O)C(C)(C)CC)CCCCCC1.CCC1(OC(=O)C(C)(C)CC)CCCCCCC1.CCCCC1(OC(=O)C(C)(C)CC)CCCC1
• InChI: InChI=1S/2C17H32O2.2C16H30O2.5C15H28O2.2C14H26O2.C13H24O2/c1-7-15(3,4)14(18)19-17(16(5,6)8-2)12-10-9-11-13-17;1-5-16(2,3)15(18)19-17(4)13-11-9-7-6-8-10-12-14-17;1-7-15(5,6)13(17)18-16(14(2,3)4)11-9-8-10-12-16;1-5-15(3,4)14(17)18-16(6-2)12-10-8-7-9-11-13-16;1-6-14(4,5)13(16)17-15(11-12(2)3)9-7-8-10-15;1-6-14(4,5)13(16)17-15(12(2)3)10-8-7-9-11-15;1-5-14(2,3)13(16)17-15(4)11-9-7-6-8-10-12-15;1-5-14(3,4)13(16)17-15(6-2)11-9-7-8-10-12-15;1-5-7-10-15(11-8-9-12-15)17-13(16)14(3,4)6-2;1-5-13(2,3)12(15)16-14(4)10-8-6-7-9-11-14;1-5-13(3,4)12(15)16-14(6-2)10-8-7-9-11-14;1-5-12(2,3)11(14)15-13(4)9-7-6-8-10-13/h7-13H2,1-6H3;5-14H2,1-4H3;7-12H2,1-6H3;5-13H2,1-4H3;2*12H,6-11H2,1-5H3;3*5-12H2,1-4H3;2*5-11H2,1-4H3;5-10H2,1-4H3
• InChIKey: BFSZYOLIVBNYEJ-UHFFFAOYSA-N
• XLogP: 53.83
• TPSA: 315.60 Ų
• H-Bond Acceptors: 24
• Rotatable Bonds: 47
• Heavy Atoms: 206
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2912.70
LogP ≤ 5	53.83
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (1-tert-butylcyclohexyl) 2,2-dimethylbutanoate;(1-butylcyclopentyl) 2,2-dimethylbutanoate;(1-ethylcycloheptyl) 2,2-dimethylbutanoate;(1-ethylcyclohexyl) 2,2-dimethylbutanoate;(1-ethylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(1-methylcyclodecyl) 2,2-dimethylbutanoate;(1-methylcycloheptyl) 2,2-dimethylbutanoate;(1-methylcyclohexyl) 2,2-dimethylbutanoate;(1-methylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylpropyl)cyclopentyl] 2,2-dimethylbutanoate;(1-propan-2-ylcyclohexyl) 2,2-dimethylbutanoate?

The IUPAC name of (1-tert-butylcyclohexyl) 2,2-dimethylbutanoate;(1-butylcyclopentyl) 2,2-dimethylbutanoate;(1-ethylcycloheptyl) 2,2-dimethylbutanoate;(1-ethylcyclohexyl) 2,2-dimethylbutanoate;(1-ethylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(1-methylcyclodecyl) 2,2-dimethylbutanoate;(1-methylcycloheptyl) 2,2-dimethylbutanoate;(1-methylcyclohexyl) 2,2-dimethylbutanoate;(1-methylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylpropyl)cyclopentyl] 2,2-dimethylbutanoate;(1-propan-2-ylcyclohexyl) 2,2-dimethylbutanoate (CID 157335066) is (1-tert-butylcyclohexyl) 2,2-dimethylbutanoate;(1-butylcyclopentyl) 2,2-dimethylbutanoate;(1-ethylcycloheptyl) 2,2-dimethylbutanoate;(1-ethylcyclohexyl) 2,2-dimethylbutanoate;(1-ethylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(1-methylcyclodecyl) 2,2-dimethylbutanoate;(1-methylcycloheptyl) 2,2-dimethylbutanoate;(1-methylcyclohexyl) 2,2-dimethylbutanoate;(1-methylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylpropyl)cyclopentyl] 2,2-dimethylbutanoate;(1-propan-2-ylcyclohexyl) 2,2-dimethylbutanoate.

What is the SMILES notation for (1-tert-butylcyclohexyl) 2,2-dimethylbutanoate;(1-butylcyclopentyl) 2,2-dimethylbutanoate;(1-ethylcycloheptyl) 2,2-dimethylbutanoate;(1-ethylcyclohexyl) 2,2-dimethylbutanoate;(1-ethylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(1-methylcyclodecyl) 2,2-dimethylbutanoate;(1-methylcycloheptyl) 2,2-dimethylbutanoate;(1-methylcyclohexyl) 2,2-dimethylbutanoate;(1-methylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylpropyl)cyclopentyl] 2,2-dimethylbutanoate;(1-propan-2-ylcyclohexyl) 2,2-dimethylbutanoate?

The canonical SMILES for (1-tert-butylcyclohexyl) 2,2-dimethylbutanoate;(1-butylcyclopentyl) 2,2-dimethylbutanoate;(1-ethylcycloheptyl) 2,2-dimethylbutanoate;(1-ethylcyclohexyl) 2,2-dimethylbutanoate;(1-ethylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(1-methylcyclodecyl) 2,2-dimethylbutanoate;(1-methylcycloheptyl) 2,2-dimethylbutanoate;(1-methylcyclohexyl) 2,2-dimethylbutanoate;(1-methylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylpropyl)cyclopentyl] 2,2-dimethylbutanoate;(1-propan-2-ylcyclohexyl) 2,2-dimethylbutanoate is CCC(C)(C)C(=O)OC1(C(C)(C)C)CCCCC1.CCC(C)(C)C(=O)OC1(C(C)(C)CC)CCCCC1.CCC(C)(C)C(=O)OC1(C(C)C)CCCCC1.CCC(C)(C)C(=O)OC1(C)CCCCC1.CCC(C)(C)C(=O)OC1(C)CCCCCC1.CCC(C)(C)C(=O)OC1(C)CCCCCCC1.CCC(C)(C)C(=O)OC1(C)CCCCCCCCC1.CCC(C)(C)C(=O)OC1(CC(C)C)CCCC1.CCC1(OC(=O)C(C)(C)CC)CCCCC1.CCC1(OC(=O)C(C)(C)CC)CCCCCC1.CCC1(OC(=O)C(C)(C)CC)CCCCCCC1.CCCCC1(OC(=O)C(C)(C)CC)CCCC1.

What is the InChIKey of (1-tert-butylcyclohexyl) 2,2-dimethylbutanoate;(1-butylcyclopentyl) 2,2-dimethylbutanoate;(1-ethylcycloheptyl) 2,2-dimethylbutanoate;(1-ethylcyclohexyl) 2,2-dimethylbutanoate;(1-ethylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(1-methylcyclodecyl) 2,2-dimethylbutanoate;(1-methylcycloheptyl) 2,2-dimethylbutanoate;(1-methylcyclohexyl) 2,2-dimethylbutanoate;(1-methylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylpropyl)cyclopentyl] 2,2-dimethylbutanoate;(1-propan-2-ylcyclohexyl) 2,2-dimethylbutanoate?

The InChIKey is BFSZYOLIVBNYEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C17H32O2.2C16H30O2.5C15H28O2.2C14H26O2.C13H24O2/c1-7-15(3,4)14(18)19-17(16(5,6)8-2)12-10-9-11-13-17;1-5-16(2,3)15(18)19-17(4)13-11-9-7-6-8-10-12-14-17;1-7-15(5,6)13(17)18-16(14(2,3)4)11-9-8-10-12-16;1-5-15(3,4)14(17)18-16(6-2)12-10-8-7-9-11-13-16;1-6-14(4,5)13(16)17-15(11-12(2)3)9-7-8-10-15;1-6-14(4,5)13(16)17-15(12(2)3)10-8-7-9-11-15;1-5-14(2,3)13(16)17-15(4)11-9-7-6-8-10-12-15;1-5-14(3,4)13(16)17-15(6-2)11-9-7-8-10-12-15;1-5-7-10-15(11-8-9-12-15)17-13(16)14(3,4)6-2;1-5-13(2,3)12(15)16-14(4)10-8-6-7-9-11-14;1-5-13(3,4)12(15)16-14(6-2)10-8-7-9-11-14;1-5-12(2,3)11(14)15-13(4)9-7-6-8-10-13/h7-13H2,1-6H3;5-14H2,1-4H3;7-12H2,1-6H3;5-13H2,1-4H3;2*12H,6-11H2,1-5H3;3*5-12H2,1-4H3;2*5-11H2,1-4H3;5-10H2,1-4H3.

What are the key properties of (1-tert-butylcyclohexyl) 2,2-dimethylbutanoate;(1-butylcyclopentyl) 2,2-dimethylbutanoate;(1-ethylcycloheptyl) 2,2-dimethylbutanoate;(1-ethylcyclohexyl) 2,2-dimethylbutanoate;(1-ethylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(1-methylcyclodecyl) 2,2-dimethylbutanoate;(1-methylcycloheptyl) 2,2-dimethylbutanoate;(1-methylcyclohexyl) 2,2-dimethylbutanoate;(1-methylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylpropyl)cyclopentyl] 2,2-dimethylbutanoate;(1-propan-2-ylcyclohexyl) 2,2-dimethylbutanoate?

(1-tert-butylcyclohexyl) 2,2-dimethylbutanoate;(1-butylcyclopentyl) 2,2-dimethylbutanoate;(1-ethylcycloheptyl) 2,2-dimethylbutanoate;(1-ethylcyclohexyl) 2,2-dimethylbutanoate;(1-ethylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(1-methylcyclodecyl) 2,2-dimethylbutanoate;(1-methylcycloheptyl) 2,2-dimethylbutanoate;(1-methylcyclohexyl) 2,2-dimethylbutanoate;(1-methylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylpropyl)cyclopentyl] 2,2-dimethylbutanoate;(1-propan-2-ylcyclohexyl) 2,2-dimethylbutanoate has a molecular weight of 2912.70 g/mol, XLogP of 53.83, 47 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for (1-tert-butylcyclohexyl) 2,2-dimethylbutanoate;(1-butylcyclopentyl) 2,2-dimethylbutanoate;(1-ethylcycloheptyl) 2,2-dimethylbutanoate;(1-ethylcyclohexyl) 2,2-dimethylbutanoate;(1-ethylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylbutan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(1-methylcyclodecyl) 2,2-dimethylbutanoate;(1-methylcycloheptyl) 2,2-dimethylbutanoate;(1-methylcyclohexyl) 2,2-dimethylbutanoate;(1-methylcyclooctyl) 2,2-dimethylbutanoate;[1-(2-methylpropyl)cyclopentyl] 2,2-dimethylbutanoate;(1-propan-2-ylcyclohexyl) 2,2-dimethylbutanoate is sourced from PubChem (CID 157335066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).