8-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;2-(3-silylpropoxy)-4,8-dioxatricyclo[4.2.1.03,7]nonan-5-one;2-(3-silylpropoxy)-4-oxatricyclo[4.2.1.03,7]nonan-5-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one

C91H150O31Si8 — CID 157078628

About 8-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;2-(3-silylpropoxy)-4,8-dioxatricyclo[4.2.1.03,7]nonan-5-one;2-(3-silylpropoxy)-4-oxatricyclo[4.2.1.03,7]nonan-5-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one

8-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;2-(3-silylpropoxy)-4,8-dioxatricyclo[4.2.1.03,7]nonan-5-one;2-(3-silylpropoxy)-4-oxatricyclo[4.2.1.03,7]nonan-5-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one (PubChem CID 157078628) has the molecular formula C91H150O31Si8 and a molecular weight of 1964.86 g/mol. Its IUPAC name is 8-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;2-(3-silylpropoxy)-4,8-dioxatricyclo[4.2.1.03,7]nonan-5-one;2-(3-silylpropoxy)-4-oxatricyclo[4.2.1.03,7]nonan-5-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one.

Molecular Properties

• Compound Name: 8-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;2-(3-silylpropoxy)-4,8-dioxatricyclo[4.2.1.03,7]nonan-5-one;2-(3-silylpropoxy)-4-oxatricyclo[4.2.1.03,7]nonan-5-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one
• PubChem CID: 157078628
• Molecular Formula: C91H150O31Si8
• Molecular Weight: 1964.86 g/mol
• Exact Mass: 1962.83
• IUPAC Name: 8-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;2-(3-silylpropoxy)-4,8-dioxatricyclo[4.2.1.03,7]nonan-5-one;2-(3-silylpropoxy)-4-oxatricyclo[4.2.1.03,7]nonan-5-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one
• SMILES: O=C1CC2(CO1)CC1CC(OCCC[SiH3])C2O1.O=C1CC2(CO1)CC1OC2CC1OCCC[SiH3].O=C1OC2C(OCCC[SiH3])C3CC1C2O3.O=C1OC2C3CC(CC13)C2OCCC[SiH3].O=C1OCC2C3CC(OCCC[SiH3])C(O3)C12.O=C1OCC2C3OC(CC3OCCC[SiH3])C12.O=C1OCCC12CC1CC(OCCC[SiH3])C2O1.O=C1OCCC12CC1OC2CC1OCCC[SiH3]
• InChI: InChI=1S/4C12H20O4Si.2C11H18O4Si.C11H18O3Si.C10H16O4Si/c13-11-12(2-4-15-11)7-9-8(6-10(12)16-9)14-3-1-5-17;13-11-12(2-4-15-11)7-8-6-9(10(12)16-8)14-3-1-5-17;13-11-6-12(7-15-11)5-9-8(4-10(12)16-9)14-2-1-3-17;13-10-6-12(7-15-10)5-8-4-9(11(12)16-8)14-2-1-3-17;12-11-9-6(5-14-11)10-8(4-7(9)15-10)13-2-1-3-16;12-11-9-6(5-14-11)7-4-8(10(9)15-7)13-2-1-3-16;12-11-8-5-6-4-7(8)10(14-11)9(6)13-2-1-3-15;11-10-5-4-6-8(12-2-1-3-15)9(14-10)7(5)13-6/h3*8-10H,1-7H2,17H3;8-9,11H,1-7H2,17H3;2*6-10H,1-5H2,16H3;6-10H,1-5H2,15H3;5-9H,1-4H2,15H3
• InChIKey: ADGPRGGZFMEROX-UHFFFAOYSA-N
• XLogP: -1.44
• TPSA: 348.85 Ų
• H-Bond Acceptors: 31
• Rotatable Bonds: 32
• Heavy Atoms: 130
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1964.86
LogP ≤ 5	-1.44
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	31

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 8-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;2-(3-silylpropoxy)-4,8-dioxatricyclo[4.2.1.03,7]nonan-5-one;2-(3-silylpropoxy)-4-oxatricyclo[4.2.1.03,7]nonan-5-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one?

The IUPAC name of 8-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;2-(3-silylpropoxy)-4,8-dioxatricyclo[4.2.1.03,7]nonan-5-one;2-(3-silylpropoxy)-4-oxatricyclo[4.2.1.03,7]nonan-5-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one (CID 157078628) is 8-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;2-(3-silylpropoxy)-4,8-dioxatricyclo[4.2.1.03,7]nonan-5-one;2-(3-silylpropoxy)-4-oxatricyclo[4.2.1.03,7]nonan-5-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one.

What is the SMILES notation for 8-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;2-(3-silylpropoxy)-4,8-dioxatricyclo[4.2.1.03,7]nonan-5-one;2-(3-silylpropoxy)-4-oxatricyclo[4.2.1.03,7]nonan-5-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one?

The canonical SMILES for 8-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;2-(3-silylpropoxy)-4,8-dioxatricyclo[4.2.1.03,7]nonan-5-one;2-(3-silylpropoxy)-4-oxatricyclo[4.2.1.03,7]nonan-5-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one is O=C1CC2(CO1)CC1CC(OCCC[SiH3])C2O1.O=C1CC2(CO1)CC1OC2CC1OCCC[SiH3].O=C1OC2C(OCCC[SiH3])C3CC1C2O3.O=C1OC2C3CC(CC13)C2OCCC[SiH3].O=C1OCC2C3CC(OCCC[SiH3])C(O3)C12.O=C1OCC2C3OC(CC3OCCC[SiH3])C12.O=C1OCCC12CC1CC(OCCC[SiH3])C2O1.O=C1OCCC12CC1OC2CC1OCCC[SiH3].

What is the InChIKey of 8-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;2-(3-silylpropoxy)-4,8-dioxatricyclo[4.2.1.03,7]nonan-5-one;2-(3-silylpropoxy)-4-oxatricyclo[4.2.1.03,7]nonan-5-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one?

The InChIKey is ADGPRGGZFMEROX-UHFFFAOYSA-N. The full InChI is InChI=1S/4C12H20O4Si.2C11H18O4Si.C11H18O3Si.C10H16O4Si/c13-11-12(2-4-15-11)7-9-8(6-10(12)16-9)14-3-1-5-17;13-11-12(2-4-15-11)7-8-6-9(10(12)16-8)14-3-1-5-17;13-11-6-12(7-15-11)5-9-8(4-10(12)16-9)14-2-1-3-17;13-10-6-12(7-15-10)5-8-4-9(11(12)16-8)14-2-1-3-17;12-11-9-6(5-14-11)10-8(4-7(9)15-10)13-2-1-3-16;12-11-9-6(5-14-11)7-4-8(10(9)15-7)13-2-1-3-16;12-11-8-5-6-4-7(8)10(14-11)9(6)13-2-1-3-15;11-10-5-4-6-8(12-2-1-3-15)9(14-10)7(5)13-6/h3*8-10H,1-7H2,17H3;8-9,11H,1-7H2,17H3;2*6-10H,1-5H2,16H3;6-10H,1-5H2,15H3;5-9H,1-4H2,15H3.

What are the key properties of 8-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;2-(3-silylpropoxy)-4,8-dioxatricyclo[4.2.1.03,7]nonan-5-one;2-(3-silylpropoxy)-4-oxatricyclo[4.2.1.03,7]nonan-5-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one?

8-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;2-(3-silylpropoxy)-4,8-dioxatricyclo[4.2.1.03,7]nonan-5-one;2-(3-silylpropoxy)-4-oxatricyclo[4.2.1.03,7]nonan-5-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one has a molecular weight of 1964.86 g/mol, XLogP of -1.44, 32 rotatable bonds, 0 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 8-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;2-(3-silylpropoxy)-4,8-dioxatricyclo[4.2.1.03,7]nonan-5-one;2-(3-silylpropoxy)-4-oxatricyclo[4.2.1.03,7]nonan-5-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-(3-silylpropoxy)spiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one is sourced from PubChem (CID 157078628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).