bis[(hydroxy-methyl-propylsilyl)oxy]-methyl-propylsilane

C12H32O4Si3 — CID 58021541

IUPACbis[(hydroxy-methyl-propylsilyl)oxy]-methyl-propylsilane
SMILESCCC[Si](C)(O)O[Si](C)(CCC)O[Si](C)(O)CCC
InChIInChI=1S/C12H32O4Si3/c1-7-10-17(4,13)15-19(6,12-9-3)16-18(5,14)11-8-2/h13-14H,7-12H2,1-6H3
InChIKeyGYWYNUZWANLYED-UHFFFAOYSA-N
MW324.64 g/mol
LogP3.45
Rot. Bonds10

About bis[(hydroxy-methyl-propylsilyl)oxy]-methyl-propylsilane

bis[(hydroxy-methyl-propylsilyl)oxy]-methyl-propylsilane (PubChem CID 58021541) has the molecular formula C12H32O4Si3 and a molecular weight of 324.64 g/mol. Its IUPAC name is bis[(hydroxy-methyl-propylsilyl)oxy]-methyl-propylsilane.

Molecular Properties

Compound Namebis[(hydroxy-methyl-propylsilyl)oxy]-methyl-propylsilane
PubChem CID58021541
Molecular FormulaC12H32O4Si3
Molecular Weight324.64 g/mol
Exact Mass324.16
IUPAC Namebis[(hydroxy-methyl-propylsilyl)oxy]-methyl-propylsilane
SMILESCCC[Si](C)(O)O[Si](C)(CCC)O[Si](C)(O)CCC
InChIInChI=1S/C12H32O4Si3/c1-7-10-17(4,13)15-19(6,12-9-3)16-18(5,14)11-8-2/h13-14H,7-12H2,1-6H3
InChIKeyGYWYNUZWANLYED-UHFFFAOYSA-N
XLogP3.45
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.64
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis[(hydroxy-methyl-propylsilyl)oxy]-methyl-propylsilane?
The IUPAC name of bis[(hydroxy-methyl-propylsilyl)oxy]-methyl-propylsilane (CID 58021541) is bis[(hydroxy-methyl-propylsilyl)oxy]-methyl-propylsilane.
What is the SMILES notation for bis[(hydroxy-methyl-propylsilyl)oxy]-methyl-propylsilane?
The canonical SMILES for bis[(hydroxy-methyl-propylsilyl)oxy]-methyl-propylsilane is CCC[Si](C)(O)O[Si](C)(CCC)O[Si](C)(O)CCC.
What is the InChIKey of bis[(hydroxy-methyl-propylsilyl)oxy]-methyl-propylsilane?
The InChIKey is GYWYNUZWANLYED-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H32O4Si3/c1-7-10-17(4,13)15-19(6,12-9-3)16-18(5,14)11-8-2/h13-14H,7-12H2,1-6H3.
What are the key properties of bis[(hydroxy-methyl-propylsilyl)oxy]-methyl-propylsilane?
bis[(hydroxy-methyl-propylsilyl)oxy]-methyl-propylsilane has a molecular weight of 324.64 g/mol, XLogP of 3.45, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis[(hydroxy-methyl-propylsilyl)oxy]-methyl-propylsilane is sourced from PubChem (CID 58021541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).