3-[ethoxy-methyl-[1-(oxiran-2-yl)propan-2-yloxy]silyl]propan-1-ol

C11H24O4Si — CID 154637990

IUPAC3-[ethoxy-methyl-[1-(oxiran-2-yl)propan-2-yloxy]silyl]propan-1-ol
SMILESCCO[Si](C)(CCCO)OC(C)CC1CO1
InChIInChI=1S/C11H24O4Si/c1-4-14-16(3,7-5-6-12)15-10(2)8-11-9-13-11/h10-12H,4-9H2,1-3H3
InChIKeyOGKAFUFPRXUZEM-UHFFFAOYSA-N
MW248.39 g/mol
LogP1.67
Rot. Bonds9

About 3-[ethoxy-methyl-[1-(oxiran-2-yl)propan-2-yloxy]silyl]propan-1-ol

3-[ethoxy-methyl-[1-(oxiran-2-yl)propan-2-yloxy]silyl]propan-1-ol (PubChem CID 154637990) has the molecular formula C11H24O4Si and a molecular weight of 248.39 g/mol. Its IUPAC name is 3-[ethoxy-methyl-[1-(oxiran-2-yl)propan-2-yloxy]silyl]propan-1-ol.

Molecular Properties

Compound Name3-[ethoxy-methyl-[1-(oxiran-2-yl)propan-2-yloxy]silyl]propan-1-ol
PubChem CID154637990
Molecular FormulaC11H24O4Si
Molecular Weight248.39 g/mol
Exact Mass248.14
IUPAC Name3-[ethoxy-methyl-[1-(oxiran-2-yl)propan-2-yloxy]silyl]propan-1-ol
SMILESCCO[Si](C)(CCCO)OC(C)CC1CO1
InChIInChI=1S/C11H24O4Si/c1-4-14-16(3,7-5-6-12)15-10(2)8-11-9-13-11/h10-12H,4-9H2,1-3H3
InChIKeyOGKAFUFPRXUZEM-UHFFFAOYSA-N
XLogP1.67
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.39
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-[ethoxy-methyl-[1-(oxiran-2-yl)propan-2-yloxy]silyl]propan-1-ol?
The IUPAC name of 3-[ethoxy-methyl-[1-(oxiran-2-yl)propan-2-yloxy]silyl]propan-1-ol (CID 154637990) is 3-[ethoxy-methyl-[1-(oxiran-2-yl)propan-2-yloxy]silyl]propan-1-ol.
What is the SMILES notation for 3-[ethoxy-methyl-[1-(oxiran-2-yl)propan-2-yloxy]silyl]propan-1-ol?
The canonical SMILES for 3-[ethoxy-methyl-[1-(oxiran-2-yl)propan-2-yloxy]silyl]propan-1-ol is CCO[Si](C)(CCCO)OC(C)CC1CO1.
What is the InChIKey of 3-[ethoxy-methyl-[1-(oxiran-2-yl)propan-2-yloxy]silyl]propan-1-ol?
The InChIKey is OGKAFUFPRXUZEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O4Si/c1-4-14-16(3,7-5-6-12)15-10(2)8-11-9-13-11/h10-12H,4-9H2,1-3H3.
What are the key properties of 3-[ethoxy-methyl-[1-(oxiran-2-yl)propan-2-yloxy]silyl]propan-1-ol?
3-[ethoxy-methyl-[1-(oxiran-2-yl)propan-2-yloxy]silyl]propan-1-ol has a molecular weight of 248.39 g/mol, XLogP of 1.67, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[ethoxy-methyl-[1-(oxiran-2-yl)propan-2-yloxy]silyl]propan-1-ol is sourced from PubChem (CID 154637990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).