bis(tert-butyl cyclohexanecarboxylate);bis(3-methoxypropylsilane);(2-methyl-2-bicyclo[2.2.1]heptanyl) cyclohexanecarboxylate;(2-methyl-2-bicyclo[2.2.1]heptanyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;bis(2-methylbutan-2-yl cyclohexanecarboxylate);2-methylbutan-2-yl 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclohexyl) cyclohexanecarboxylate;(1-methylcyclohexyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclopentyl) cyclohexanecarboxylate;(1-methylcyclopentyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) cyclohexanecarboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;methylsilane;propylsilane

C201H394O35Si13 — CID 159280747

About bis(tert-butyl cyclohexanecarboxylate);bis(3-methoxypropylsilane);(2-methyl-2-bicyclo[2.2.1]heptanyl) cyclohexanecarboxylate;(2-methyl-2-bicyclo[2.2.1]heptanyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;bis(2-methylbutan-2-yl cyclohexanecarboxylate);2-methylbutan-2-yl 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclohexyl) cyclohexanecarboxylate;(1-methylcyclohexyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclopentyl) cyclohexanecarboxylate;(1-methylcyclopentyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) cyclohexanecarboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;methylsilane;propylsilane

bis(tert-butyl cyclohexanecarboxylate);bis(3-methoxypropylsilane);(2-methyl-2-bicyclo[2.2.1]heptanyl) cyclohexanecarboxylate;(2-methyl-2-bicyclo[2.2.1]heptanyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;bis(2-methylbutan-2-yl cyclohexanecarboxylate);2-methylbutan-2-yl 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclohexyl) cyclohexanecarboxylate;(1-methylcyclohexyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclopentyl) cyclohexanecarboxylate;(1-methylcyclopentyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) cyclohexanecarboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;methylsilane;propylsilane (PubChem CID 159280747) has the molecular formula C201H394O35Si13 and a molecular weight of 3736.45 g/mol. Its IUPAC name is bis(tert-butyl cyclohexanecarboxylate);bis(3-methoxypropylsilane);(2-methyl-2-bicyclo[2.2.1]heptanyl) cyclohexanecarboxylate;(2-methyl-2-bicyclo[2.2.1]heptanyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;bis(2-methylbutan-2-yl cyclohexanecarboxylate);2-methylbutan-2-yl 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclohexyl) cyclohexanecarboxylate;(1-methylcyclohexyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclopentyl) cyclohexanecarboxylate;(1-methylcyclopentyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) cyclohexanecarboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;methylsilane;propylsilane.

Molecular Properties

• Compound Name: bis(tert-butyl cyclohexanecarboxylate);bis(3-methoxypropylsilane);(2-methyl-2-bicyclo[2.2.1]heptanyl) cyclohexanecarboxylate;(2-methyl-2-bicyclo[2.2.1]heptanyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;bis(2-methylbutan-2-yl cyclohexanecarboxylate);2-methylbutan-2-yl 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclohexyl) cyclohexanecarboxylate;(1-methylcyclohexyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclopentyl) cyclohexanecarboxylate;(1-methylcyclopentyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) cyclohexanecarboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;methylsilane;propylsilane
• PubChem CID: 159280747
• Molecular Formula: C201H394O35Si13
• Molecular Weight: 3736.45 g/mol
• Exact Mass: 3732.61
• IUPAC Name: bis(tert-butyl cyclohexanecarboxylate);bis(3-methoxypropylsilane);(2-methyl-2-bicyclo[2.2.1]heptanyl) cyclohexanecarboxylate;(2-methyl-2-bicyclo[2.2.1]heptanyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;bis(2-methylbutan-2-yl cyclohexanecarboxylate);2-methylbutan-2-yl 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclohexyl) cyclohexanecarboxylate;(1-methylcyclohexyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclopentyl) cyclohexanecarboxylate;(1-methylcyclopentyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) cyclohexanecarboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;methylsilane;propylsilane
• SMILES: CC(C)(C)OC(=O)C1CCCCC1.CC(C)(C)OC(=O)C1CCCCC1.CC1(OC(=O)C2CC3CCC2O3)CC2CCC1C2.CC1(OC(=O)C2CC3CCC2O3)CC2CCC1O2.CC1(OC(=O)C2CC3CCC2O3)CCCC1.CC1(OC(=O)C2CC3CCC2O3)CCCCC1.CC1(OC(=O)C2CCCCC2)CC2CCC1C2.CC1(OC(=O)C2CCCCC2)CC2CCC1O2.CC1(OC(=O)C2CCCCC2)CCCC1.CC1(OC(=O)C2CCCCC2)CCCCC1.CCC(C)(C)OC(=O)C1CC2CCC1O2.CCC(C)(C)OC(=O)C1CCCCC1.CCC(C)(C)OC(=O)C1CCCCC1.CCC[SiH3].CCC[SiH3].CCC[SiH3].CCC[SiH3].CCC[SiH3].CCC[SiH3].COCCC[SiH3].COCCC[SiH3].C[SiH3].C[SiH3].C[SiH3].C[SiH3].C[SiH3]
• InChI: InChI=1S/C15H22O3.C15H24O2.C14H20O4.2C14H22O3.C14H24O2.C13H20O3.C13H22O2.C12H20O3.2C12H22O2.2C11H20O2.2C4H12OSi.6C3H10Si.5CH6Si/c1-15(8-9-2-3-10(15)6-9)18-14(16)12-7-11-4-5-13(12)17-11;1-15(10-11-7-8-13(15)9-11)17-14(16)12-5-3-2-4-6-12;1-14(7-9-3-5-12(14)17-9)18-13(15)10-6-8-2-4-11(10)16-8;1-14(7-3-2-4-8-14)17-13(15)11-9-10-5-6-12(11)16-10;1-14(9-11-7-8-12(14)16-11)17-13(15)10-5-3-2-4-6-10;1-14(10-6-3-7-11-14)16-13(15)12-8-4-2-5-9-12;1-13(6-2-3-7-13)16-12(14)10-8-9-4-5-11(10)15-9;1-13(9-5-6-10-13)15-12(14)11-7-3-2-4-8-11;1-4-12(2,3)15-11(13)9-7-8-5-6-10(9)14-8;2*1-4-12(2,3)14-11(13)10-8-6-5-7-9-10;2*1-11(2,3)13-10(12)9-7-5-4-6-8-9;2*1-5-3-2-4-6;6*1-2-3-4;5*1-2/h9-13H,2-8H2,1H3;11-13H,2-10H2,1H3;8-12H,2-7H2,1H3;2*10-12H,2-9H2,1H3;12H,2-11H2,1H3;9-11H,2-8H2,1H3;11H,2-10H2,1H3;8-10H,4-7H2,1-3H3;2*10H,4-9H2,1-3H3;2*9H,4-8H2,1-3H3;2*2-4H2,1,6H3;6*2-3H2,1,4H3;5*1-2H3
• InChIKey: KYWPNIBZUHFGNY-UHFFFAOYSA-N
• XLogP: 35.91
• TPSA: 424.97 Ų
• H-Bond Acceptors: 35
• Rotatable Bonds: 39
• Heavy Atoms: 249
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3736.45
LogP ≤ 5	35.91
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	35

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of bis(tert-butyl cyclohexanecarboxylate);bis(3-methoxypropylsilane);(2-methyl-2-bicyclo[2.2.1]heptanyl) cyclohexanecarboxylate;(2-methyl-2-bicyclo[2.2.1]heptanyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;bis(2-methylbutan-2-yl cyclohexanecarboxylate);2-methylbutan-2-yl 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclohexyl) cyclohexanecarboxylate;(1-methylcyclohexyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclopentyl) cyclohexanecarboxylate;(1-methylcyclopentyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) cyclohexanecarboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;methylsilane;propylsilane?

The IUPAC name of bis(tert-butyl cyclohexanecarboxylate);bis(3-methoxypropylsilane);(2-methyl-2-bicyclo[2.2.1]heptanyl) cyclohexanecarboxylate;(2-methyl-2-bicyclo[2.2.1]heptanyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;bis(2-methylbutan-2-yl cyclohexanecarboxylate);2-methylbutan-2-yl 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclohexyl) cyclohexanecarboxylate;(1-methylcyclohexyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclopentyl) cyclohexanecarboxylate;(1-methylcyclopentyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) cyclohexanecarboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;methylsilane;propylsilane (CID 159280747) is bis(tert-butyl cyclohexanecarboxylate);bis(3-methoxypropylsilane);(2-methyl-2-bicyclo[2.2.1]heptanyl) cyclohexanecarboxylate;(2-methyl-2-bicyclo[2.2.1]heptanyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;bis(2-methylbutan-2-yl cyclohexanecarboxylate);2-methylbutan-2-yl 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclohexyl) cyclohexanecarboxylate;(1-methylcyclohexyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclopentyl) cyclohexanecarboxylate;(1-methylcyclopentyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) cyclohexanecarboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;methylsilane;propylsilane.

What is the SMILES notation for bis(tert-butyl cyclohexanecarboxylate);bis(3-methoxypropylsilane);(2-methyl-2-bicyclo[2.2.1]heptanyl) cyclohexanecarboxylate;(2-methyl-2-bicyclo[2.2.1]heptanyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;bis(2-methylbutan-2-yl cyclohexanecarboxylate);2-methylbutan-2-yl 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclohexyl) cyclohexanecarboxylate;(1-methylcyclohexyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclopentyl) cyclohexanecarboxylate;(1-methylcyclopentyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) cyclohexanecarboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;methylsilane;propylsilane?

The canonical SMILES for bis(tert-butyl cyclohexanecarboxylate);bis(3-methoxypropylsilane);(2-methyl-2-bicyclo[2.2.1]heptanyl) cyclohexanecarboxylate;(2-methyl-2-bicyclo[2.2.1]heptanyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;bis(2-methylbutan-2-yl cyclohexanecarboxylate);2-methylbutan-2-yl 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclohexyl) cyclohexanecarboxylate;(1-methylcyclohexyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclopentyl) cyclohexanecarboxylate;(1-methylcyclopentyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) cyclohexanecarboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;methylsilane;propylsilane is CC(C)(C)OC(=O)C1CCCCC1.CC(C)(C)OC(=O)C1CCCCC1.CC1(OC(=O)C2CC3CCC2O3)CC2CCC1C2.CC1(OC(=O)C2CC3CCC2O3)CC2CCC1O2.CC1(OC(=O)C2CC3CCC2O3)CCCC1.CC1(OC(=O)C2CC3CCC2O3)CCCCC1.CC1(OC(=O)C2CCCCC2)CC2CCC1C2.CC1(OC(=O)C2CCCCC2)CC2CCC1O2.CC1(OC(=O)C2CCCCC2)CCCC1.CC1(OC(=O)C2CCCCC2)CCCCC1.CCC(C)(C)OC(=O)C1CC2CCC1O2.CCC(C)(C)OC(=O)C1CCCCC1.CCC(C)(C)OC(=O)C1CCCCC1.CCC[SiH3].CCC[SiH3].CCC[SiH3].CCC[SiH3].CCC[SiH3].CCC[SiH3].COCCC[SiH3].COCCC[SiH3].C[SiH3].C[SiH3].C[SiH3].C[SiH3].C[SiH3].

What is the InChIKey of bis(tert-butyl cyclohexanecarboxylate);bis(3-methoxypropylsilane);(2-methyl-2-bicyclo[2.2.1]heptanyl) cyclohexanecarboxylate;(2-methyl-2-bicyclo[2.2.1]heptanyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;bis(2-methylbutan-2-yl cyclohexanecarboxylate);2-methylbutan-2-yl 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclohexyl) cyclohexanecarboxylate;(1-methylcyclohexyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclopentyl) cyclohexanecarboxylate;(1-methylcyclopentyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) cyclohexanecarboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;methylsilane;propylsilane?

The InChIKey is KYWPNIBZUHFGNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O3.C15H24O2.C14H20O4.2C14H22O3.C14H24O2.C13H20O3.C13H22O2.C12H20O3.2C12H22O2.2C11H20O2.2C4H12OSi.6C3H10Si.5CH6Si/c1-15(8-9-2-3-10(15)6-9)18-14(16)12-7-11-4-5-13(12)17-11;1-15(10-11-7-8-13(15)9-11)17-14(16)12-5-3-2-4-6-12;1-14(7-9-3-5-12(14)17-9)18-13(15)10-6-8-2-4-11(10)16-8;1-14(7-3-2-4-8-14)17-13(15)11-9-10-5-6-12(11)16-10;1-14(9-11-7-8-12(14)16-11)17-13(15)10-5-3-2-4-6-10;1-14(10-6-3-7-11-14)16-13(15)12-8-4-2-5-9-12;1-13(6-2-3-7-13)16-12(14)10-8-9-4-5-11(10)15-9;1-13(9-5-6-10-13)15-12(14)11-7-3-2-4-8-11;1-4-12(2,3)15-11(13)9-7-8-5-6-10(9)14-8;2*1-4-12(2,3)14-11(13)10-8-6-5-7-9-10;2*1-11(2,3)13-10(12)9-7-5-4-6-8-9;2*1-5-3-2-4-6;6*1-2-3-4;5*1-2/h9-13H,2-8H2,1H3;11-13H,2-10H2,1H3;8-12H,2-7H2,1H3;2*10-12H,2-9H2,1H3;12H,2-11H2,1H3;9-11H,2-8H2,1H3;11H,2-10H2,1H3;8-10H,4-7H2,1-3H3;2*10H,4-9H2,1-3H3;2*9H,4-8H2,1-3H3;2*2-4H2,1,6H3;6*2-3H2,1,4H3;5*1-2H3.

What are the key properties of bis(tert-butyl cyclohexanecarboxylate);bis(3-methoxypropylsilane);(2-methyl-2-bicyclo[2.2.1]heptanyl) cyclohexanecarboxylate;(2-methyl-2-bicyclo[2.2.1]heptanyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;bis(2-methylbutan-2-yl cyclohexanecarboxylate);2-methylbutan-2-yl 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclohexyl) cyclohexanecarboxylate;(1-methylcyclohexyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclopentyl) cyclohexanecarboxylate;(1-methylcyclopentyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) cyclohexanecarboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;methylsilane;propylsilane?

bis(tert-butyl cyclohexanecarboxylate);bis(3-methoxypropylsilane);(2-methyl-2-bicyclo[2.2.1]heptanyl) cyclohexanecarboxylate;(2-methyl-2-bicyclo[2.2.1]heptanyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;bis(2-methylbutan-2-yl cyclohexanecarboxylate);2-methylbutan-2-yl 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclohexyl) cyclohexanecarboxylate;(1-methylcyclohexyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclopentyl) cyclohexanecarboxylate;(1-methylcyclopentyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) cyclohexanecarboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;methylsilane;propylsilane has a molecular weight of 3736.45 g/mol, XLogP of 35.91, 39 rotatable bonds, 0 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for bis(tert-butyl cyclohexanecarboxylate);bis(3-methoxypropylsilane);(2-methyl-2-bicyclo[2.2.1]heptanyl) cyclohexanecarboxylate;(2-methyl-2-bicyclo[2.2.1]heptanyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;bis(2-methylbutan-2-yl cyclohexanecarboxylate);2-methylbutan-2-yl 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclohexyl) cyclohexanecarboxylate;(1-methylcyclohexyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(1-methylcyclopentyl) cyclohexanecarboxylate;(1-methylcyclopentyl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) cyclohexanecarboxylate;(2-methyl-7-oxabicyclo[2.2.1]heptan-2-yl) 7-oxabicyclo[2.2.1]heptane-2-carboxylate;methylsilane;propylsilane is sourced from PubChem (CID 159280747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).