3-[(3-ethyloxetan-3-yl)methoxy]propyl-[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-[[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methylsilane

C34H72O9Si4 — CID 20730169

IUPAC3-[(3-ethyloxetan-3-yl)methoxy]propyl-[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-[[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methylsilane
SMILESCCC1(COCCC[Si](C)(C)O[Si](C)(C)O[Si](C)(CCCOCC2(CC)COC2)O[Si](C)(C)CCCOCC2(CC)COC2)COC1
InChIInChI=1S/C34H72O9Si4/c1-11-32(26-38-27-32)23-35-17-14-20-44(4,5)41-46(8,9)43-47(10,22-16-19-37-25-34(13-3)30-40-31-34)42-45(6,7)21-15-18-36-24-33(12-2)28-39-29-33/h11-31H2,1-10H3
InChIKeyBIKPFEBYYSWNTN-UHFFFAOYSA-N
MW737.28 g/mol
LogP7.72
Rot. Bonds27

About 3-[(3-ethyloxetan-3-yl)methoxy]propyl-[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-[[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methylsilane

3-[(3-ethyloxetan-3-yl)methoxy]propyl-[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-[[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methylsilane (PubChem CID 20730169) has the molecular formula C34H72O9Si4 and a molecular weight of 737.28 g/mol. Its IUPAC name is 3-[(3-ethyloxetan-3-yl)methoxy]propyl-[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-[[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methylsilane.

Molecular Properties

Compound Name3-[(3-ethyloxetan-3-yl)methoxy]propyl-[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-[[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methylsilane
PubChem CID20730169
Molecular FormulaC34H72O9Si4
Molecular Weight737.28 g/mol
Exact Mass736.43
IUPAC Name3-[(3-ethyloxetan-3-yl)methoxy]propyl-[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-[[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methylsilane
SMILESCCC1(COCCC[Si](C)(C)O[Si](C)(C)O[Si](C)(CCCOCC2(CC)COC2)O[Si](C)(C)CCCOCC2(CC)COC2)COC1
InChIInChI=1S/C34H72O9Si4/c1-11-32(26-38-27-32)23-35-17-14-20-44(4,5)41-46(8,9)43-47(10,22-16-19-37-25-34(13-3)30-40-31-34)42-45(6,7)21-15-18-36-24-33(12-2)28-39-29-33/h11-31H2,1-10H3
InChIKeyBIKPFEBYYSWNTN-UHFFFAOYSA-N
XLogP7.72
TPSA83.07 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds27
Heavy Atoms47
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500737.28
LogP ≤ 57.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

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 3-[(3-ethyloxetan-3-yl)methoxy]propyl-[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-[[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methylsilane?
The IUPAC name of 3-[(3-ethyloxetan-3-yl)methoxy]propyl-[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-[[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methylsilane (CID 20730169) is 3-[(3-ethyloxetan-3-yl)methoxy]propyl-[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-[[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methylsilane.
What is the SMILES notation for 3-[(3-ethyloxetan-3-yl)methoxy]propyl-[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-[[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methylsilane?
The canonical SMILES for 3-[(3-ethyloxetan-3-yl)methoxy]propyl-[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-[[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methylsilane is CCC1(COCCC[Si](C)(C)O[Si](C)(C)O[Si](C)(CCCOCC2(CC)COC2)O[Si](C)(C)CCCOCC2(CC)COC2)COC1.
What is the InChIKey of 3-[(3-ethyloxetan-3-yl)methoxy]propyl-[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-[[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methylsilane?
The InChIKey is BIKPFEBYYSWNTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H72O9Si4/c1-11-32(26-38-27-32)23-35-17-14-20-44(4,5)41-46(8,9)43-47(10,22-16-19-37-25-34(13-3)30-40-31-34)42-45(6,7)21-15-18-36-24-33(12-2)28-39-29-33/h11-31H2,1-10H3.
What are the key properties of 3-[(3-ethyloxetan-3-yl)methoxy]propyl-[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-[[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methylsilane?
3-[(3-ethyloxetan-3-yl)methoxy]propyl-[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-[[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methylsilane has a molecular weight of 737.28 g/mol, XLogP of 7.72, 27 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-ethyloxetan-3-yl)methoxy]propyl-[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-[[3-[(3-ethyloxetan-3-yl)methoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methylsilane is sourced from PubChem (CID 20730169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).