trimethyl-[methyl-[3-[3-(oxolan-2-ylmethoxy)propoxy]propyl]-trimethylsilyloxysilyl]oxysilane

C18H42O5Si3 — CID 70660178

IUPACtrimethyl-[methyl-[3-[3-(oxolan-2-ylmethoxy)propoxy]propyl]-trimethylsilyloxysilyl]oxysilane
SMILESC[Si](C)(C)O[Si](C)(CCCOCCCOCC1CCCO1)O[Si](C)(C)C
InChIInChI=1S/C18H42O5Si3/c1-24(2,3)22-26(7,23-25(4,5)6)16-10-14-19-12-9-13-20-17-18-11-8-15-21-18/h18H,8-17H2,1-7H3
InChIKeyDSDINCIQIPWKOB-UHFFFAOYSA-N
MW422.79 g/mol
LogP4.75
Rot. Bonds14

About trimethyl-[methyl-[3-[3-(oxolan-2-ylmethoxy)propoxy]propyl]-trimethylsilyloxysilyl]oxysilane

trimethyl-[methyl-[3-[3-(oxolan-2-ylmethoxy)propoxy]propyl]-trimethylsilyloxysilyl]oxysilane (PubChem CID 70660178) has the molecular formula C18H42O5Si3 and a molecular weight of 422.79 g/mol. Its IUPAC name is trimethyl-[methyl-[3-[3-(oxolan-2-ylmethoxy)propoxy]propyl]-trimethylsilyloxysilyl]oxysilane.

Molecular Properties

Compound Nametrimethyl-[methyl-[3-[3-(oxolan-2-ylmethoxy)propoxy]propyl]-trimethylsilyloxysilyl]oxysilane
PubChem CID70660178
Molecular FormulaC18H42O5Si3
Molecular Weight422.79 g/mol
Exact Mass422.23
IUPAC Nametrimethyl-[methyl-[3-[3-(oxolan-2-ylmethoxy)propoxy]propyl]-trimethylsilyloxysilyl]oxysilane
SMILESC[Si](C)(C)O[Si](C)(CCCOCCCOCC1CCCO1)O[Si](C)(C)C
InChIInChI=1S/C18H42O5Si3/c1-24(2,3)22-26(7,23-25(4,5)6)16-10-14-19-12-9-13-20-17-18-11-8-15-21-18/h18H,8-17H2,1-7H3
InChIKeyDSDINCIQIPWKOB-UHFFFAOYSA-N
XLogP4.75
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds14
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.79
LogP ≤ 54.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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 trimethyl-[methyl-[3-[3-(oxolan-2-ylmethoxy)propoxy]propyl]-trimethylsilyloxysilyl]oxysilane?
The IUPAC name of trimethyl-[methyl-[3-[3-(oxolan-2-ylmethoxy)propoxy]propyl]-trimethylsilyloxysilyl]oxysilane (CID 70660178) is trimethyl-[methyl-[3-[3-(oxolan-2-ylmethoxy)propoxy]propyl]-trimethylsilyloxysilyl]oxysilane.
What is the SMILES notation for trimethyl-[methyl-[3-[3-(oxolan-2-ylmethoxy)propoxy]propyl]-trimethylsilyloxysilyl]oxysilane?
The canonical SMILES for trimethyl-[methyl-[3-[3-(oxolan-2-ylmethoxy)propoxy]propyl]-trimethylsilyloxysilyl]oxysilane is C[Si](C)(C)O[Si](C)(CCCOCCCOCC1CCCO1)O[Si](C)(C)C.
What is the InChIKey of trimethyl-[methyl-[3-[3-(oxolan-2-ylmethoxy)propoxy]propyl]-trimethylsilyloxysilyl]oxysilane?
The InChIKey is DSDINCIQIPWKOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H42O5Si3/c1-24(2,3)22-26(7,23-25(4,5)6)16-10-14-19-12-9-13-20-17-18-11-8-15-21-18/h18H,8-17H2,1-7H3.
What are the key properties of trimethyl-[methyl-[3-[3-(oxolan-2-ylmethoxy)propoxy]propyl]-trimethylsilyloxysilyl]oxysilane?
trimethyl-[methyl-[3-[3-(oxolan-2-ylmethoxy)propoxy]propyl]-trimethylsilyloxysilyl]oxysilane has a molecular weight of 422.79 g/mol, XLogP of 4.75, 14 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[methyl-[3-[3-(oxolan-2-ylmethoxy)propoxy]propyl]-trimethylsilyloxysilyl]oxysilane is sourced from PubChem (CID 70660178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).