diethoxy-[1-methoxy-1-(3-methyloxetan-3-yl)propyl]-methylsilane

C13H28O4Si — CID 23440458

IUPACdiethoxy-[1-methoxy-1-(3-methyloxetan-3-yl)propyl]-methylsilane
SMILESCCO[Si](C)(OCC)C(CC)(OC)C1(C)COC1
InChIInChI=1S/C13H28O4Si/c1-7-13(14-5,12(4)10-15-11-12)18(6,16-8-2)17-9-3/h7-11H2,1-6H3
InChIKeyXVFAZKDYQFUYBG-UHFFFAOYSA-N
MW276.45 g/mol
LogP2.50
Rot. Bonds8

About diethoxy-[1-methoxy-1-(3-methyloxetan-3-yl)propyl]-methylsilane

diethoxy-[1-methoxy-1-(3-methyloxetan-3-yl)propyl]-methylsilane (PubChem CID 23440458) has the molecular formula C13H28O4Si and a molecular weight of 276.45 g/mol. Its IUPAC name is diethoxy-[1-methoxy-1-(3-methyloxetan-3-yl)propyl]-methylsilane.

Molecular Properties

Compound Namediethoxy-[1-methoxy-1-(3-methyloxetan-3-yl)propyl]-methylsilane
PubChem CID23440458
Molecular FormulaC13H28O4Si
Molecular Weight276.45 g/mol
Exact Mass276.18
IUPAC Namediethoxy-[1-methoxy-1-(3-methyloxetan-3-yl)propyl]-methylsilane
SMILESCCO[Si](C)(OCC)C(CC)(OC)C1(C)COC1
InChIInChI=1S/C13H28O4Si/c1-7-13(14-5,12(4)10-15-11-12)18(6,16-8-2)17-9-3/h7-11H2,1-6H3
InChIKeyXVFAZKDYQFUYBG-UHFFFAOYSA-N
XLogP2.50
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.45
LogP ≤ 52.50
H-Bond Donors ≤ 50
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 diethoxy-[1-methoxy-1-(3-methyloxetan-3-yl)propyl]-methylsilane?
The IUPAC name of diethoxy-[1-methoxy-1-(3-methyloxetan-3-yl)propyl]-methylsilane (CID 23440458) is diethoxy-[1-methoxy-1-(3-methyloxetan-3-yl)propyl]-methylsilane.
What is the SMILES notation for diethoxy-[1-methoxy-1-(3-methyloxetan-3-yl)propyl]-methylsilane?
The canonical SMILES for diethoxy-[1-methoxy-1-(3-methyloxetan-3-yl)propyl]-methylsilane is CCO[Si](C)(OCC)C(CC)(OC)C1(C)COC1.
What is the InChIKey of diethoxy-[1-methoxy-1-(3-methyloxetan-3-yl)propyl]-methylsilane?
The InChIKey is XVFAZKDYQFUYBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O4Si/c1-7-13(14-5,12(4)10-15-11-12)18(6,16-8-2)17-9-3/h7-11H2,1-6H3.
What are the key properties of diethoxy-[1-methoxy-1-(3-methyloxetan-3-yl)propyl]-methylsilane?
diethoxy-[1-methoxy-1-(3-methyloxetan-3-yl)propyl]-methylsilane has a molecular weight of 276.45 g/mol, XLogP of 2.50, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy-[1-methoxy-1-(3-methyloxetan-3-yl)propyl]-methylsilane is sourced from PubChem (CID 23440458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).