methyl 2-[4-[3-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]-5-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]methyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[2-[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]propan-2-yl]cyclohexyl]phenoxy]acetate

C145H174O33 — CID 160762690

About methyl 2-[4-[3-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]-5-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]methyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[2-[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]propan-2-yl]cyclohexyl]phenoxy]acetate

methyl 2-[4-[3-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]-5-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]methyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[2-[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]propan-2-yl]cyclohexyl]phenoxy]acetate (PubChem CID 160762690) has the molecular formula C145H174O33 and a molecular weight of 2444.95 g/mol. Its IUPAC name is methyl 2-[4-[3-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]-5-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]methyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[2-[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]propan-2-yl]cyclohexyl]phenoxy]acetate.

Molecular Properties

• Compound Name: methyl 2-[4-[3-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]-5-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]methyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[2-[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]propan-2-yl]cyclohexyl]phenoxy]acetate
• PubChem CID: 160762690
• Molecular Formula: C145H174O33
• Molecular Weight: 2444.95 g/mol
• Exact Mass: 2443.19
• IUPAC Name: methyl 2-[4-[3-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]-5-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]methyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[2-[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]propan-2-yl]cyclohexyl]phenoxy]acetate
• SMILES: COC(=O)COc1ccc(C2CC(c3ccc(OCC(=O)OC)cc3)CC(C3CC(c4ccc(OCC(=O)OC)cc4)CC(c4ccc(OCC(=O)OC)cc4)C3)C2)cc1.COC(=O)COc1ccc(C2CC(c3ccc(OCC(=O)OC)cc3)CC(c3ccc(OCC(=O)OC)cc3)C2)cc1.COC(=O)COc1ccc(C2CCC(C(C)(C)C3CCC(c4ccc(OCC(=O)OC)cc4)CC3)CC2)cc1.COC(=O)COc1ccc(C2CCC(CC3CCC(c4ccc(OCC(=O)OC)cc4)CC3)CC2)cc1
• InChI: InChI=1S/C48H54O12.C33H36O9.C33H44O6.C31H40O6/c1-53-45(49)27-57-41-13-5-31(6-14-41)35-21-36(32-7-15-42(16-8-32)58-28-46(50)54-2)24-39(23-35)40-25-37(33-9-17-43(18-10-33)59-29-47(51)55-3)22-38(26-40)34-11-19-44(20-12-34)60-30-48(52)56-4;1-37-31(34)19-40-28-10-4-22(5-11-28)25-16-26(23-6-12-29(13-7-23)41-20-32(35)38-2)18-27(17-25)24-8-14-30(15-9-24)42-21-33(36)39-3;1-33(2,27-13-5-23(6-14-27)25-9-17-29(18-10-25)38-21-31(34)36-3)28-15-7-24(8-16-28)26-11-19-30(20-12-26)39-22-32(35)37-4;1-34-30(32)20-36-28-15-11-26(12-16-28)24-7-3-22(4-8-24)19-23-5-9-25(10-6-23)27-13-17-29(18-14-27)37-21-31(33)35-2/h5-20,35-40H,21-30H2,1-4H3;4-15,25-27H,16-21H2,1-3H3;9-12,17-20,23-24,27-28H,5-8,13-16,21-22H2,1-4H3;11-18,22-25H,3-10,19-21H2,1-2H3
• InChIKey: RYGROHOJUBYQPT-UHFFFAOYSA-N
• XLogP: 26.60
• TPSA: 390.83 Ų
• H-Bond Acceptors: 33
• Rotatable Bonds: 49
• Heavy Atoms: 178
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2444.95
LogP ≤ 5	26.60
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	33

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of methyl 2-[4-[3-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]-5-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]methyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[2-[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]propan-2-yl]cyclohexyl]phenoxy]acetate?

The IUPAC name of methyl 2-[4-[3-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]-5-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]methyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[2-[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]propan-2-yl]cyclohexyl]phenoxy]acetate (CID 160762690) is methyl 2-[4-[3-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]-5-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]methyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[2-[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]propan-2-yl]cyclohexyl]phenoxy]acetate.

What is the SMILES notation for methyl 2-[4-[3-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]-5-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]methyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[2-[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]propan-2-yl]cyclohexyl]phenoxy]acetate?

The canonical SMILES for methyl 2-[4-[3-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]-5-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]methyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[2-[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]propan-2-yl]cyclohexyl]phenoxy]acetate is COC(=O)COc1ccc(C2CC(c3ccc(OCC(=O)OC)cc3)CC(C3CC(c4ccc(OCC(=O)OC)cc4)CC(c4ccc(OCC(=O)OC)cc4)C3)C2)cc1.COC(=O)COc1ccc(C2CC(c3ccc(OCC(=O)OC)cc3)CC(c3ccc(OCC(=O)OC)cc3)C2)cc1.COC(=O)COc1ccc(C2CCC(C(C)(C)C3CCC(c4ccc(OCC(=O)OC)cc4)CC3)CC2)cc1.COC(=O)COc1ccc(C2CCC(CC3CCC(c4ccc(OCC(=O)OC)cc4)CC3)CC2)cc1.

What is the InChIKey of methyl 2-[4-[3-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]-5-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]methyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[2-[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]propan-2-yl]cyclohexyl]phenoxy]acetate?

The InChIKey is RYGROHOJUBYQPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H54O12.C33H36O9.C33H44O6.C31H40O6/c1-53-45(49)27-57-41-13-5-31(6-14-41)35-21-36(32-7-15-42(16-8-32)58-28-46(50)54-2)24-39(23-35)40-25-37(33-9-17-43(18-10-33)59-29-47(51)55-3)22-38(26-40)34-11-19-44(20-12-34)60-30-48(52)56-4;1-37-31(34)19-40-28-10-4-22(5-11-28)25-16-26(23-6-12-29(13-7-23)41-20-32(35)38-2)18-27(17-25)24-8-14-30(15-9-24)42-21-33(36)39-3;1-33(2,27-13-5-23(6-14-27)25-9-17-29(18-10-25)38-21-31(34)36-3)28-15-7-24(8-16-28)26-11-19-30(20-12-26)39-22-32(35)37-4;1-34-30(32)20-36-28-15-11-26(12-16-28)24-7-3-22(4-8-24)19-23-5-9-25(10-6-23)27-13-17-29(18-14-27)37-21-31(33)35-2/h5-20,35-40H,21-30H2,1-4H3;4-15,25-27H,16-21H2,1-3H3;9-12,17-20,23-24,27-28H,5-8,13-16,21-22H2,1-4H3;11-18,22-25H,3-10,19-21H2,1-2H3.

What are the key properties of methyl 2-[4-[3-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]-5-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]methyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[2-[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]propan-2-yl]cyclohexyl]phenoxy]acetate?

methyl 2-[4-[3-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]-5-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]methyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[2-[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]propan-2-yl]cyclohexyl]phenoxy]acetate has a molecular weight of 2444.95 g/mol, XLogP of 26.60, 49 rotatable bonds, 0 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for methyl 2-[4-[3-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]-5-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[3,5-bis[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]methyl]cyclohexyl]phenoxy]acetate;methyl 2-[4-[4-[2-[4-[4-(2-methoxy-2-oxoethoxy)phenyl]cyclohexyl]propan-2-yl]cyclohexyl]phenoxy]acetate is sourced from PubChem (CID 160762690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).