[2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-(1-cyclopentylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;bis([2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate);[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-oxo-2-(1-prop-1-ynylcyclopentyl)oxyethyl] 2-methylbutanoate

C129H216O32 — CID 162136223

About [2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-(1-cyclopentylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;bis([2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate);[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-oxo-2-(1-prop-1-ynylcyclopentyl)oxyethyl] 2-methylbutanoate

[2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-(1-cyclopentylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;bis([2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate);[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-oxo-2-(1-prop-1-ynylcyclopentyl)oxyethyl] 2-methylbutanoate (PubChem CID 162136223) has the molecular formula C129H216O32 and a molecular weight of 2279.11 g/mol. Its IUPAC name is [2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-(1-cyclopentylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;bis([2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate);[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-oxo-2-(1-prop-1-ynylcyclopentyl)oxyethyl] 2-methylbutanoate.

Molecular Properties

• Compound Name: [2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-(1-cyclopentylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;bis([2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate);[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-oxo-2-(1-prop-1-ynylcyclopentyl)oxyethyl] 2-methylbutanoate
• PubChem CID: 162136223
• Molecular Formula: C129H216O32
• Molecular Weight: 2279.11 g/mol
• Exact Mass: 2277.53
• IUPAC Name: [2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-(1-cyclopentylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;bis([2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate);[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-oxo-2-(1-prop-1-ynylcyclopentyl)oxyethyl] 2-methylbutanoate
• SMILES: CC#CC1(OC(=O)COC(=O)C(C)CC)CCCC1.CCC(C)(C)C(=O)OCC(=O)OC1(C)CCCCC1.CCC(C)(C)C(=O)OCC(=O)OC1(C)CCCCC1.CCC(C)(C)C(=O)OCC(=O)OC1(C2CCCC2)CCCC1.CCC(C)(C)C(=O)OCC(=O)OC1(C2CCCCC2)CCCC1.CCC(C)C(=O)OCC(=O)OC1(C)CCCC1.CCC(C)C(=O)OCC(=O)OC1(C2CCCCC2)CCCC1.CCC1(OC(=O)COC(=O)C(C)(C)CC)CCCCC1
• InChI: InChI=1S/C19H32O4.2C18H30O4.C16H28O4.2C15H26O4.C15H22O4.C13H22O4/c1-4-18(2,3)17(21)22-14-16(20)23-19(12-8-9-13-19)15-10-6-5-7-11-15;1-4-17(2,3)16(20)21-13-15(19)22-18(11-7-8-12-18)14-9-5-6-10-14;1-3-14(2)17(20)21-13-16(19)22-18(11-7-8-12-18)15-9-5-4-6-10-15;1-5-15(3,4)14(18)19-12-13(17)20-16(6-2)10-8-7-9-11-16;2*1-5-14(2,3)13(17)18-11-12(16)19-15(4)9-7-6-8-10-15;1-4-8-15(9-6-7-10-15)19-13(16)11-18-14(17)12(3)5-2;1-4-10(2)12(15)16-9-11(14)17-13(3)7-5-6-8-13/h15H,4-14H2,1-3H3;14H,4-13H2,1-3H3;14-15H,3-13H2,1-2H3;5-12H2,1-4H3;2*5-11H2,1-4H3;12H,5-7,9-11H2,1-3H3;10H,4-9H2,1-3H3
• InChIKey: ZJIBMUNVCDYMPC-UHFFFAOYSA-N
• XLogP: 27.42
• TPSA: 420.80 Ų
• H-Bond Acceptors: 32
• Rotatable Bonds: 44
• Heavy Atoms: 161
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2279.11
LogP ≤ 5	27.42
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-(1-cyclopentylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;bis([2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate);[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-oxo-2-(1-prop-1-ynylcyclopentyl)oxyethyl] 2-methylbutanoate?

The IUPAC name of [2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-(1-cyclopentylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;bis([2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate);[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-oxo-2-(1-prop-1-ynylcyclopentyl)oxyethyl] 2-methylbutanoate (CID 162136223) is [2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-(1-cyclopentylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;bis([2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate);[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-oxo-2-(1-prop-1-ynylcyclopentyl)oxyethyl] 2-methylbutanoate.

What is the SMILES notation for [2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-(1-cyclopentylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;bis([2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate);[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-oxo-2-(1-prop-1-ynylcyclopentyl)oxyethyl] 2-methylbutanoate?

The canonical SMILES for [2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-(1-cyclopentylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;bis([2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate);[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-oxo-2-(1-prop-1-ynylcyclopentyl)oxyethyl] 2-methylbutanoate is CC#CC1(OC(=O)COC(=O)C(C)CC)CCCC1.CCC(C)(C)C(=O)OCC(=O)OC1(C)CCCCC1.CCC(C)(C)C(=O)OCC(=O)OC1(C)CCCCC1.CCC(C)(C)C(=O)OCC(=O)OC1(C2CCCC2)CCCC1.CCC(C)(C)C(=O)OCC(=O)OC1(C2CCCCC2)CCCC1.CCC(C)C(=O)OCC(=O)OC1(C)CCCC1.CCC(C)C(=O)OCC(=O)OC1(C2CCCCC2)CCCC1.CCC1(OC(=O)COC(=O)C(C)(C)CC)CCCCC1.

What is the InChIKey of [2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-(1-cyclopentylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;bis([2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate);[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-oxo-2-(1-prop-1-ynylcyclopentyl)oxyethyl] 2-methylbutanoate?

The InChIKey is ZJIBMUNVCDYMPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32O4.2C18H30O4.C16H28O4.2C15H26O4.C15H22O4.C13H22O4/c1-4-18(2,3)17(21)22-14-16(20)23-19(12-8-9-13-19)15-10-6-5-7-11-15;1-4-17(2,3)16(20)21-13-15(19)22-18(11-7-8-12-18)14-9-5-6-10-14;1-3-14(2)17(20)21-13-16(19)22-18(11-7-8-12-18)15-9-5-4-6-10-15;1-5-15(3,4)14(18)19-12-13(17)20-16(6-2)10-8-7-9-11-16;2*1-5-14(2,3)13(17)18-11-12(16)19-15(4)9-7-6-8-10-15;1-4-8-15(9-6-7-10-15)19-13(16)11-18-14(17)12(3)5-2;1-4-10(2)12(15)16-9-11(14)17-13(3)7-5-6-8-13/h15H,4-14H2,1-3H3;14H,4-13H2,1-3H3;14-15H,3-13H2,1-2H3;5-12H2,1-4H3;2*5-11H2,1-4H3;12H,5-7,9-11H2,1-3H3;10H,4-9H2,1-3H3.

What are the key properties of [2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-(1-cyclopentylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;bis([2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate);[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-oxo-2-(1-prop-1-ynylcyclopentyl)oxyethyl] 2-methylbutanoate?

[2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-(1-cyclopentylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;bis([2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate);[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-oxo-2-(1-prop-1-ynylcyclopentyl)oxyethyl] 2-methylbutanoate has a molecular weight of 2279.11 g/mol, XLogP of 27.42, 44 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for [2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-(1-cyclopentylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;bis([2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate);[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2-methylbutanoate;[2-oxo-2-(1-prop-1-ynylcyclopentyl)oxyethyl] 2-methylbutanoate is sourced from PubChem (CID 162136223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).