[dimethyl-[3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropyl]silyl]oxy-dimethyl-(2-triethoxysilylethyl)silane;dimethylsilyloxy-dimethyl-(2-triethoxysilylethyl)silane

C37H89NO9Si6 — CID 158602623

IUPAC[dimethyl-[3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropyl]silyl]oxy-dimethyl-(2-triethoxysilylethyl)silane;dimethylsilyloxy-dimethyl-(2-triethoxysilylethyl)silane
SMILESCCO[Si](CC[Si](C)(C)O[SiH](C)C)(OCC)OCC.CCO[Si](CC[Si](C)(C)O[Si](C)(C)CCCOC1CC(C)(C)N(C)C(C)(C)C1)(OCC)OCC
InChIInChI=1S/C25H57NO5Si3.C12H32O4Si3/c1-13-28-34(29-14-2,30-15-3)20-19-33(11,12)31-32(9,10)18-16-17-27-23-21-24(4,5)26(8)25(6,7)22-23;1-8-13-19(14-9-2,15-10-3)12-11-18(6,7)16-17(4)5/h23H,13-22H2,1-12H3;17H,8-12H2,1-7H3
InChIKeyHVVFBFGTGWWBLO-UHFFFAOYSA-N
MW860.63 g/mol
LogP9.76
Rot. Bonds27

About [dimethyl-[3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropyl]silyl]oxy-dimethyl-(2-triethoxysilylethyl)silane;dimethylsilyloxy-dimethyl-(2-triethoxysilylethyl)silane

[dimethyl-[3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropyl]silyl]oxy-dimethyl-(2-triethoxysilylethyl)silane;dimethylsilyloxy-dimethyl-(2-triethoxysilylethyl)silane (PubChem CID 158602623) has the molecular formula C37H89NO9Si6 and a molecular weight of 860.63 g/mol. Its IUPAC name is [dimethyl-[3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropyl]silyl]oxy-dimethyl-(2-triethoxysilylethyl)silane;dimethylsilyloxy-dimethyl-(2-triethoxysilylethyl)silane.

Molecular Properties

Compound Name[dimethyl-[3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropyl]silyl]oxy-dimethyl-(2-triethoxysilylethyl)silane;dimethylsilyloxy-dimethyl-(2-triethoxysilylethyl)silane
PubChem CID158602623
Molecular FormulaC37H89NO9Si6
Molecular Weight860.63 g/mol
Exact Mass859.52
IUPAC Name[dimethyl-[3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropyl]silyl]oxy-dimethyl-(2-triethoxysilylethyl)silane;dimethylsilyloxy-dimethyl-(2-triethoxysilylethyl)silane
SMILESCCO[Si](CC[Si](C)(C)O[SiH](C)C)(OCC)OCC.CCO[Si](CC[Si](C)(C)O[Si](C)(C)CCCOC1CC(C)(C)N(C)C(C)(C)C1)(OCC)OCC
InChIInChI=1S/C25H57NO5Si3.C12H32O4Si3/c1-13-28-34(29-14-2,30-15-3)20-19-33(11,12)31-32(9,10)18-16-17-27-23-21-24(4,5)26(8)25(6,7)22-23;1-8-13-19(14-9-2,15-10-3)12-11-18(6,7)16-17(4)5/h23H,13-22H2,1-12H3;17H,8-12H2,1-7H3
InChIKeyHVVFBFGTGWWBLO-UHFFFAOYSA-N
XLogP9.76
TPSA86.31 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds27
Heavy Atoms53
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500860.63
LogP ≤ 59.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [dimethyl-[3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropyl]silyl]oxy-dimethyl-(2-triethoxysilylethyl)silane;dimethylsilyloxy-dimethyl-(2-triethoxysilylethyl)silane?
The IUPAC name of [dimethyl-[3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropyl]silyl]oxy-dimethyl-(2-triethoxysilylethyl)silane;dimethylsilyloxy-dimethyl-(2-triethoxysilylethyl)silane (CID 158602623) is [dimethyl-[3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropyl]silyl]oxy-dimethyl-(2-triethoxysilylethyl)silane;dimethylsilyloxy-dimethyl-(2-triethoxysilylethyl)silane.
What is the SMILES notation for [dimethyl-[3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropyl]silyl]oxy-dimethyl-(2-triethoxysilylethyl)silane;dimethylsilyloxy-dimethyl-(2-triethoxysilylethyl)silane?
The canonical SMILES for [dimethyl-[3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropyl]silyl]oxy-dimethyl-(2-triethoxysilylethyl)silane;dimethylsilyloxy-dimethyl-(2-triethoxysilylethyl)silane is CCO[Si](CC[Si](C)(C)O[SiH](C)C)(OCC)OCC.CCO[Si](CC[Si](C)(C)O[Si](C)(C)CCCOC1CC(C)(C)N(C)C(C)(C)C1)(OCC)OCC.
What is the InChIKey of [dimethyl-[3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropyl]silyl]oxy-dimethyl-(2-triethoxysilylethyl)silane;dimethylsilyloxy-dimethyl-(2-triethoxysilylethyl)silane?
The InChIKey is HVVFBFGTGWWBLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H57NO5Si3.C12H32O4Si3/c1-13-28-34(29-14-2,30-15-3)20-19-33(11,12)31-32(9,10)18-16-17-27-23-21-24(4,5)26(8)25(6,7)22-23;1-8-13-19(14-9-2,15-10-3)12-11-18(6,7)16-17(4)5/h23H,13-22H2,1-12H3;17H,8-12H2,1-7H3.
What are the key properties of [dimethyl-[3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropyl]silyl]oxy-dimethyl-(2-triethoxysilylethyl)silane;dimethylsilyloxy-dimethyl-(2-triethoxysilylethyl)silane?
[dimethyl-[3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropyl]silyl]oxy-dimethyl-(2-triethoxysilylethyl)silane;dimethylsilyloxy-dimethyl-(2-triethoxysilylethyl)silane has a molecular weight of 860.63 g/mol, XLogP of 9.76, 27 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for [dimethyl-[3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropyl]silyl]oxy-dimethyl-(2-triethoxysilylethyl)silane;dimethylsilyloxy-dimethyl-(2-triethoxysilylethyl)silane is sourced from PubChem (CID 158602623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).