2-[2-[2-[2-[2-[2-[2-[2-[2-[3-[[dimethyl(propyl)silyl]oxy-dimethylsilyloxy-methylsilyl]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol

C29H66O12Si3 — CID 158395250

IUPAC2-[2-[2-[2-[2-[2-[2-[2-[2-[3-[[dimethyl(propyl)silyl]oxy-dimethylsilyloxy-methylsilyl]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
SMILESCCC[Si](C)(C)O[Si](C)(CCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)O[SiH](C)C
InChIInChI=1S/C29H66O12Si3/c1-7-28-43(4,5)41-44(6,40-42(2)3)29-8-10-31-12-14-33-16-18-35-20-22-37-24-26-39-27-25-38-23-21-36-19-17-34-15-13-32-11-9-30/h30,42H,7-29H2,1-6H3
InChIKeyKLUKIRVZBBKQCK-UHFFFAOYSA-N
MW691.09 g/mol
LogP3.22
Rot. Bonds36

About 2-[2-[2-[2-[2-[2-[2-[2-[2-[3-[[dimethyl(propyl)silyl]oxy-dimethylsilyloxy-methylsilyl]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol

2-[2-[2-[2-[2-[2-[2-[2-[2-[3-[[dimethyl(propyl)silyl]oxy-dimethylsilyloxy-methylsilyl]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol (PubChem CID 158395250) has the molecular formula C29H66O12Si3 and a molecular weight of 691.09 g/mol. Its IUPAC name is 2-[2-[2-[2-[2-[2-[2-[2-[2-[3-[[dimethyl(propyl)silyl]oxy-dimethylsilyloxy-methylsilyl]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-[2-[2-[2-[2-[2-[2-[2-[3-[[dimethyl(propyl)silyl]oxy-dimethylsilyloxy-methylsilyl]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
PubChem CID158395250
Molecular FormulaC29H66O12Si3
Molecular Weight691.09 g/mol
Exact Mass690.39
IUPAC Name2-[2-[2-[2-[2-[2-[2-[2-[2-[3-[[dimethyl(propyl)silyl]oxy-dimethylsilyloxy-methylsilyl]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
SMILESCCC[Si](C)(C)O[Si](C)(CCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)O[SiH](C)C
InChIInChI=1S/C29H66O12Si3/c1-7-28-43(4,5)41-44(6,40-42(2)3)29-8-10-31-12-14-33-16-18-35-20-22-37-24-26-39-27-25-38-23-21-36-19-17-34-15-13-32-11-9-30/h30,42H,7-29H2,1-6H3
InChIKeyKLUKIRVZBBKQCK-UHFFFAOYSA-N
XLogP3.22
TPSA121.76 Ų
H-Bond Donors1
H-Bond Acceptors12
Rotatable Bonds36
Heavy Atoms44
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500691.09
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[2-[2-[2-[2-[2-[2-[3-[[dimethyl(propyl)silyl]oxy-dimethylsilyloxy-methylsilyl]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol?
The IUPAC name of 2-[2-[2-[2-[2-[2-[2-[2-[2-[3-[[dimethyl(propyl)silyl]oxy-dimethylsilyloxy-methylsilyl]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol (CID 158395250) is 2-[2-[2-[2-[2-[2-[2-[2-[2-[3-[[dimethyl(propyl)silyl]oxy-dimethylsilyloxy-methylsilyl]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol.
What is the SMILES notation for 2-[2-[2-[2-[2-[2-[2-[2-[2-[3-[[dimethyl(propyl)silyl]oxy-dimethylsilyloxy-methylsilyl]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol?
The canonical SMILES for 2-[2-[2-[2-[2-[2-[2-[2-[2-[3-[[dimethyl(propyl)silyl]oxy-dimethylsilyloxy-methylsilyl]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol is CCC[Si](C)(C)O[Si](C)(CCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)O[SiH](C)C.
What is the InChIKey of 2-[2-[2-[2-[2-[2-[2-[2-[2-[3-[[dimethyl(propyl)silyl]oxy-dimethylsilyloxy-methylsilyl]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol?
The InChIKey is KLUKIRVZBBKQCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H66O12Si3/c1-7-28-43(4,5)41-44(6,40-42(2)3)29-8-10-31-12-14-33-16-18-35-20-22-37-24-26-39-27-25-38-23-21-36-19-17-34-15-13-32-11-9-30/h30,42H,7-29H2,1-6H3.
What are the key properties of 2-[2-[2-[2-[2-[2-[2-[2-[2-[3-[[dimethyl(propyl)silyl]oxy-dimethylsilyloxy-methylsilyl]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol?
2-[2-[2-[2-[2-[2-[2-[2-[2-[3-[[dimethyl(propyl)silyl]oxy-dimethylsilyloxy-methylsilyl]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol has a molecular weight of 691.09 g/mol, XLogP of 3.22, 36 rotatable bonds, 1 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[2-[2-[2-[2-[2-[2-[3-[[dimethyl(propyl)silyl]oxy-dimethylsilyloxy-methylsilyl]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol is sourced from PubChem (CID 158395250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).