[1,3,5,7,9,11,14-heptamethyl-7,14-bis(methylsilyloxy)-2,4,6,8,10,12,13,15,16-nonaoxa-1,3,5,7,9,11,14-heptasilatricyclo[7.3.3.15,11]hexadecan-3-yl]oxy-methylsilane;methane

C13H48O12Si10 — CID 161330789

About [1,3,5,7,9,11,14-heptamethyl-7,14-bis(methylsilyloxy)-2,4,6,8,10,12,13,15,16-nonaoxa-1,3,5,7,9,11,14-heptasilatricyclo[7.3.3.15,11]hexadecan-3-yl]oxy-methylsilane;methane

[1,3,5,7,9,11,14-heptamethyl-7,14-bis(methylsilyloxy)-2,4,6,8,10,12,13,15,16-nonaoxa-1,3,5,7,9,11,14-heptasilatricyclo[7.3.3.15,11]hexadecan-3-yl]oxy-methylsilane;methane (PubChem CID 161330789) has the molecular formula C13H48O12Si10 and a molecular weight of 677.38 g/mol. Its IUPAC name is [1,3,5,7,9,11,14-heptamethyl-7,14-bis(methylsilyloxy)-2,4,6,8,10,12,13,15,16-nonaoxa-1,3,5,7,9,11,14-heptasilatricyclo[7.3.3.15,11]hexadecan-3-yl]oxy-methylsilane;methane.

Molecular Properties

• Compound Name: [1,3,5,7,9,11,14-heptamethyl-7,14-bis(methylsilyloxy)-2,4,6,8,10,12,13,15,16-nonaoxa-1,3,5,7,9,11,14-heptasilatricyclo[7.3.3.15,11]hexadecan-3-yl]oxy-methylsilane;methane
• PubChem CID: 161330789
• Molecular Formula: C13H48O12Si10
• Molecular Weight: 677.38 g/mol
• Exact Mass: 676.08
• IUPAC Name: [1,3,5,7,9,11,14-heptamethyl-7,14-bis(methylsilyloxy)-2,4,6,8,10,12,13,15,16-nonaoxa-1,3,5,7,9,11,14-heptasilatricyclo[7.3.3.15,11]hexadecan-3-yl]oxy-methylsilane;methane
• SMILES: C.C.C.C[SiH2]O[Si]1(C)O[Si]2(C)O[Si](C)(O[SiH2]C)O[Si]3(C)O[Si](C)(O[SiH2]C)O[Si](C)(O1)O[Si](C)(O2)O3
• InChI: InChI=1S/C10H36O12Si10.3CH4/c1-23-11-26(4)14-29(7)16-27(5,12-24-2)18-31(9)19-28(6,13-25-3)17-30(8,15-26)21-32(10,20-29)22-31;;;/h23-25H2,1-10H3;3*1H4
• InChIKey: VLJTYTVXWHBSLK-UHFFFAOYSA-N
• XLogP: 1.51
• TPSA: 110.76 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 6
• Heavy Atoms: 35
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	677.38
LogP ≤ 5	1.51
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [1,3,5,7,9,11,14-heptamethyl-7,14-bis(methylsilyloxy)-2,4,6,8,10,12,13,15,16-nonaoxa-1,3,5,7,9,11,14-heptasilatricyclo[7.3.3.15,11]hexadecan-3-yl]oxy-methylsilane;methane?

The IUPAC name of [1,3,5,7,9,11,14-heptamethyl-7,14-bis(methylsilyloxy)-2,4,6,8,10,12,13,15,16-nonaoxa-1,3,5,7,9,11,14-heptasilatricyclo[7.3.3.15,11]hexadecan-3-yl]oxy-methylsilane;methane (CID 161330789) is [1,3,5,7,9,11,14-heptamethyl-7,14-bis(methylsilyloxy)-2,4,6,8,10,12,13,15,16-nonaoxa-1,3,5,7,9,11,14-heptasilatricyclo[7.3.3.15,11]hexadecan-3-yl]oxy-methylsilane;methane.

What is the SMILES notation for [1,3,5,7,9,11,14-heptamethyl-7,14-bis(methylsilyloxy)-2,4,6,8,10,12,13,15,16-nonaoxa-1,3,5,7,9,11,14-heptasilatricyclo[7.3.3.15,11]hexadecan-3-yl]oxy-methylsilane;methane?

The canonical SMILES for [1,3,5,7,9,11,14-heptamethyl-7,14-bis(methylsilyloxy)-2,4,6,8,10,12,13,15,16-nonaoxa-1,3,5,7,9,11,14-heptasilatricyclo[7.3.3.15,11]hexadecan-3-yl]oxy-methylsilane;methane is C.C.C.C[SiH2]O[Si]1(C)O[Si]2(C)O[Si](C)(O[SiH2]C)O[Si]3(C)O[Si](C)(O[SiH2]C)O[Si](C)(O1)O[Si](C)(O2)O3.

What is the InChIKey of [1,3,5,7,9,11,14-heptamethyl-7,14-bis(methylsilyloxy)-2,4,6,8,10,12,13,15,16-nonaoxa-1,3,5,7,9,11,14-heptasilatricyclo[7.3.3.15,11]hexadecan-3-yl]oxy-methylsilane;methane?

The InChIKey is VLJTYTVXWHBSLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H36O12Si10.3CH4/c1-23-11-26(4)14-29(7)16-27(5,12-24-2)18-31(9)19-28(6,13-25-3)17-30(8,15-26)21-32(10,20-29)22-31;;;/h23-25H2,1-10H3;3*1H4.

What are the key properties of [1,3,5,7,9,11,14-heptamethyl-7,14-bis(methylsilyloxy)-2,4,6,8,10,12,13,15,16-nonaoxa-1,3,5,7,9,11,14-heptasilatricyclo[7.3.3.15,11]hexadecan-3-yl]oxy-methylsilane;methane?

[1,3,5,7,9,11,14-heptamethyl-7,14-bis(methylsilyloxy)-2,4,6,8,10,12,13,15,16-nonaoxa-1,3,5,7,9,11,14-heptasilatricyclo[7.3.3.15,11]hexadecan-3-yl]oxy-methylsilane;methane has a molecular weight of 677.38 g/mol, XLogP of 1.51, 6 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for [1,3,5,7,9,11,14-heptamethyl-7,14-bis(methylsilyloxy)-2,4,6,8,10,12,13,15,16-nonaoxa-1,3,5,7,9,11,14-heptasilatricyclo[7.3.3.15,11]hexadecan-3-yl]oxy-methylsilane;methane is sourced from PubChem (CID 161330789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).