[2-[2-(1-adamantyl)ethoxy]-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantylmethoxy)-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantyloxy)-2-oxoethyl] 2-hydroxyacetate;(2-methoxy-2-oxoethyl) 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl)oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-(2-oxooxolan-3-yl)oxyethyl] 2-hydroxyacetate;[2-oxo-2-[[(4S)-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl]oxy]ethyl] 2-hydroxyacetate;tricyclo[5.2.1.02,6]decane

C121H166O54 — CID 158440116

About [2-[2-(1-adamantyl)ethoxy]-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantylmethoxy)-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantyloxy)-2-oxoethyl] 2-hydroxyacetate;(2-methoxy-2-oxoethyl) 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl)oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-(2-oxooxolan-3-yl)oxyethyl] 2-hydroxyacetate;[2-oxo-2-[[(4S)-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl]oxy]ethyl] 2-hydroxyacetate;tricyclo[5.2.1.02,6]decane

[2-[2-(1-adamantyl)ethoxy]-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantylmethoxy)-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantyloxy)-2-oxoethyl] 2-hydroxyacetate;(2-methoxy-2-oxoethyl) 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl)oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-(2-oxooxolan-3-yl)oxyethyl] 2-hydroxyacetate;[2-oxo-2-[[(4S)-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl]oxy]ethyl] 2-hydroxyacetate;tricyclo[5.2.1.02,6]decane (PubChem CID 158440116) has the molecular formula C121H166O54 and a molecular weight of 2484.61 g/mol. Its IUPAC name is [2-[2-(1-adamantyl)ethoxy]-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantylmethoxy)-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantyloxy)-2-oxoethyl] 2-hydroxyacetate;(2-methoxy-2-oxoethyl) 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl)oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-(2-oxooxolan-3-yl)oxyethyl] 2-hydroxyacetate;[2-oxo-2-[[(4S)-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl]oxy]ethyl] 2-hydroxyacetate;tricyclo[5.2.1.02,6]decane.

Molecular Properties

• Compound Name: [2-[2-(1-adamantyl)ethoxy]-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantylmethoxy)-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantyloxy)-2-oxoethyl] 2-hydroxyacetate;(2-methoxy-2-oxoethyl) 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl)oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-(2-oxooxolan-3-yl)oxyethyl] 2-hydroxyacetate;[2-oxo-2-[[(4S)-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl]oxy]ethyl] 2-hydroxyacetate;tricyclo[5.2.1.02,6]decane
• PubChem CID: 158440116
• Molecular Formula: C121H166O54
• Molecular Weight: 2484.61 g/mol
• Exact Mass: 2483.02
• IUPAC Name: [2-[2-(1-adamantyl)ethoxy]-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantylmethoxy)-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantyloxy)-2-oxoethyl] 2-hydroxyacetate;(2-methoxy-2-oxoethyl) 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl)oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-(2-oxooxolan-3-yl)oxyethyl] 2-hydroxyacetate;[2-oxo-2-[[(4S)-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl]oxy]ethyl] 2-hydroxyacetate;tricyclo[5.2.1.02,6]decane
• SMILES: C1CC2C3CCC(C3)C2C1.COC(=O)COC(=O)CO.O=C(CO)OCC(=O)OC12CC3CC(C1)OC(=O)C(C3)C2.O=C(CO)OCC(=O)OC12CC3CC(CC(C3)C1)C2.O=C(CO)OCC(=O)OC1CCOC1=O.O=C(CO)OCC(=O)OCC12CC3CC(CC(C3)C1)C2.O=C(CO)OCC(=O)OCCC12CC3CC(CC(C3)C1)C2.O=C(CO)OCC(=O)O[C@@H]1C2CC3C(=O)OC1C3C2.O=C(CO)OCC(=O)O[C@@H]1C2CC3C(=O)OC1C3O2.O=C(CO)OCC(=O)O[C@H]1CC2CC1C1C3CCC(C3)C21
• InChI: InChI=1S/C16H22O5.C16H24O5.C15H22O5.C14H18O7.C14H20O5.C12H14O7.C11H12O8.C10H16.C8H10O7.C5H8O5/c17-6-13(18)20-7-14(19)21-12-5-10-4-11(12)16-9-2-1-8(3-9)15(10)16;17-9-14(18)21-10-15(19)20-2-1-16-6-11-3-12(7-16)5-13(4-11)8-16;16-7-13(17)19-8-14(18)20-9-15-4-10-1-11(5-15)3-12(2-10)6-15;15-6-11(16)19-7-12(17)21-14-3-8-1-9(4-14)13(18)20-10(2-8)5-14;15-7-12(16)18-8-13(17)19-14-4-9-1-10(5-14)3-11(2-9)6-14;13-3-8(14)17-4-9(15)18-10-5-1-6-7(2-5)12(16)19-11(6)10;12-2-6(13)16-3-7(14)18-9-5-1-4-8(17-5)10(9)19-11(4)15;1-2-9-7-4-5-8(6-7)10(9)3-1;9-3-6(10)14-4-7(11)15-5-1-2-13-8(5)12;1-9-5(8)3-10-4(7)2-6/h8-12,15-17H,1-7H2;11-13,17H,1-10H2;10-12,16H,1-9H2;8-10,15H,1-7H2;9-11,15H,1-8H2;5-7,10-11,13H,1-4H2;4-5,8-10,12H,1-3H2;7-10H,1-6H2;5,9H,1-4H2;6H,2-3H2,1H3/t8?,9?,10?,11?,12-,15?,16?;;;;;5?,6?,7?,10-,11?;4?,5?,8?,9-,10?;;;/m0....11.../s1
• InChIKey: HCSHFLROHKOYOF-SAZPQOJISA-N
• XLogP: 2.13
• TPSA: 769.90 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 54
• Rotatable Bonds: 38
• Heavy Atoms: 175
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2484.61
LogP ≤ 5	2.13
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	54

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'cyclooctane_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [2-[2-(1-adamantyl)ethoxy]-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantylmethoxy)-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantyloxy)-2-oxoethyl] 2-hydroxyacetate;(2-methoxy-2-oxoethyl) 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl)oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-(2-oxooxolan-3-yl)oxyethyl] 2-hydroxyacetate;[2-oxo-2-[[(4S)-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl]oxy]ethyl] 2-hydroxyacetate;tricyclo[5.2.1.02,6]decane?

The IUPAC name of [2-[2-(1-adamantyl)ethoxy]-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantylmethoxy)-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantyloxy)-2-oxoethyl] 2-hydroxyacetate;(2-methoxy-2-oxoethyl) 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl)oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-(2-oxooxolan-3-yl)oxyethyl] 2-hydroxyacetate;[2-oxo-2-[[(4S)-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl]oxy]ethyl] 2-hydroxyacetate;tricyclo[5.2.1.02,6]decane (CID 158440116) is [2-[2-(1-adamantyl)ethoxy]-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantylmethoxy)-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantyloxy)-2-oxoethyl] 2-hydroxyacetate;(2-methoxy-2-oxoethyl) 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl)oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-(2-oxooxolan-3-yl)oxyethyl] 2-hydroxyacetate;[2-oxo-2-[[(4S)-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl]oxy]ethyl] 2-hydroxyacetate;tricyclo[5.2.1.02,6]decane.

What is the SMILES notation for [2-[2-(1-adamantyl)ethoxy]-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantylmethoxy)-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantyloxy)-2-oxoethyl] 2-hydroxyacetate;(2-methoxy-2-oxoethyl) 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl)oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-(2-oxooxolan-3-yl)oxyethyl] 2-hydroxyacetate;[2-oxo-2-[[(4S)-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl]oxy]ethyl] 2-hydroxyacetate;tricyclo[5.2.1.02,6]decane?

The canonical SMILES for [2-[2-(1-adamantyl)ethoxy]-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantylmethoxy)-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantyloxy)-2-oxoethyl] 2-hydroxyacetate;(2-methoxy-2-oxoethyl) 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl)oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-(2-oxooxolan-3-yl)oxyethyl] 2-hydroxyacetate;[2-oxo-2-[[(4S)-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl]oxy]ethyl] 2-hydroxyacetate;tricyclo[5.2.1.02,6]decane is C1CC2C3CCC(C3)C2C1.COC(=O)COC(=O)CO.O=C(CO)OCC(=O)OC12CC3CC(C1)OC(=O)C(C3)C2.O=C(CO)OCC(=O)OC12CC3CC(CC(C3)C1)C2.O=C(CO)OCC(=O)OC1CCOC1=O.O=C(CO)OCC(=O)OCC12CC3CC(CC(C3)C1)C2.O=C(CO)OCC(=O)OCCC12CC3CC(CC(C3)C1)C2.O=C(CO)OCC(=O)O[C@@H]1C2CC3C(=O)OC1C3C2.O=C(CO)OCC(=O)O[C@@H]1C2CC3C(=O)OC1C3O2.O=C(CO)OCC(=O)O[C@H]1CC2CC1C1C3CCC(C3)C21.

What is the InChIKey of [2-[2-(1-adamantyl)ethoxy]-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantylmethoxy)-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantyloxy)-2-oxoethyl] 2-hydroxyacetate;(2-methoxy-2-oxoethyl) 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl)oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-(2-oxooxolan-3-yl)oxyethyl] 2-hydroxyacetate;[2-oxo-2-[[(4S)-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl]oxy]ethyl] 2-hydroxyacetate;tricyclo[5.2.1.02,6]decane?

The InChIKey is HCSHFLROHKOYOF-SAZPQOJISA-N. The full InChI is InChI=1S/C16H22O5.C16H24O5.C15H22O5.C14H18O7.C14H20O5.C12H14O7.C11H12O8.C10H16.C8H10O7.C5H8O5/c17-6-13(18)20-7-14(19)21-12-5-10-4-11(12)16-9-2-1-8(3-9)15(10)16;17-9-14(18)21-10-15(19)20-2-1-16-6-11-3-12(7-16)5-13(4-11)8-16;16-7-13(17)19-8-14(18)20-9-15-4-10-1-11(5-15)3-12(2-10)6-15;15-6-11(16)19-7-12(17)21-14-3-8-1-9(4-14)13(18)20-10(2-8)5-14;15-7-12(16)18-8-13(17)19-14-4-9-1-10(5-14)3-11(2-9)6-14;13-3-8(14)17-4-9(15)18-10-5-1-6-7(2-5)12(16)19-11(6)10;12-2-6(13)16-3-7(14)18-9-5-1-4-8(17-5)10(9)19-11(4)15;1-2-9-7-4-5-8(6-7)10(9)3-1;9-3-6(10)14-4-7(11)15-5-1-2-13-8(5)12;1-9-5(8)3-10-4(7)2-6/h8-12,15-17H,1-7H2;11-13,17H,1-10H2;10-12,16H,1-9H2;8-10,15H,1-7H2;9-11,15H,1-8H2;5-7,10-11,13H,1-4H2;4-5,8-10,12H,1-3H2;7-10H,1-6H2;5,9H,1-4H2;6H,2-3H2,1H3/t8?,9?,10?,11?,12-,15?,16?;;;;;5?,6?,7?,10-,11?;4?,5?,8?,9-,10?;;;/m0....11.../s1.

What are the key properties of [2-[2-(1-adamantyl)ethoxy]-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantylmethoxy)-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantyloxy)-2-oxoethyl] 2-hydroxyacetate;(2-methoxy-2-oxoethyl) 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl)oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-(2-oxooxolan-3-yl)oxyethyl] 2-hydroxyacetate;[2-oxo-2-[[(4S)-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl]oxy]ethyl] 2-hydroxyacetate;tricyclo[5.2.1.02,6]decane?

[2-[2-(1-adamantyl)ethoxy]-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantylmethoxy)-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantyloxy)-2-oxoethyl] 2-hydroxyacetate;(2-methoxy-2-oxoethyl) 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl)oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-(2-oxooxolan-3-yl)oxyethyl] 2-hydroxyacetate;[2-oxo-2-[[(4S)-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl]oxy]ethyl] 2-hydroxyacetate;tricyclo[5.2.1.02,6]decane has a molecular weight of 2484.61 g/mol, XLogP of 2.13, 38 rotatable bonds, 9 hydrogen bond donors, and 54 hydrogen bond acceptors.

Where does this data come from?

All data for [2-[2-(1-adamantyl)ethoxy]-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantylmethoxy)-2-oxoethyl] 2-hydroxyacetate;[2-(1-adamantyloxy)-2-oxoethyl] 2-hydroxyacetate;(2-methoxy-2-oxoethyl) 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4,8-dioxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[[(2R)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl]oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.3.1.13,8]undecan-1-yl)oxy]ethyl] 2-hydroxyacetate;[2-oxo-2-(2-oxooxolan-3-yl)oxyethyl] 2-hydroxyacetate;[2-oxo-2-[[(4S)-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl]oxy]ethyl] 2-hydroxyacetate;tricyclo[5.2.1.02,6]decane is sourced from PubChem (CID 158440116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).