1-(1-trimethylsilylethoxy)propan-2-ol

C8H20O2Si — CID 23048068

IUPAC1-(1-trimethylsilylethoxy)propan-2-ol
SMILESCC(O)COC(C)[Si](C)(C)C
InChIInChI=1S/C8H20O2Si/c1-7(9)6-10-8(2)11(3,4)5/h7-9H,6H2,1-5H3
InChIKeyIBBKALRSRYYXEI-UHFFFAOYSA-N
MW176.33 g/mol
LogP1.65
Rot. Bonds4

About 1-(1-trimethylsilylethoxy)propan-2-ol

1-(1-trimethylsilylethoxy)propan-2-ol (PubChem CID 23048068) has the molecular formula C8H20O2Si and a molecular weight of 176.33 g/mol. Its IUPAC name is 1-(1-trimethylsilylethoxy)propan-2-ol.

Molecular Properties

Compound Name1-(1-trimethylsilylethoxy)propan-2-ol
PubChem CID23048068
Molecular FormulaC8H20O2Si
Molecular Weight176.33 g/mol
Exact Mass176.12
IUPAC Name1-(1-trimethylsilylethoxy)propan-2-ol
SMILESCC(O)COC(C)[Si](C)(C)C
InChIInChI=1S/C8H20O2Si/c1-7(9)6-10-8(2)11(3,4)5/h7-9H,6H2,1-5H3
InChIKeyIBBKALRSRYYXEI-UHFFFAOYSA-N
XLogP1.65
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.33
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 1-(1-trimethylsilylethoxy)propan-2-ol?
The IUPAC name of 1-(1-trimethylsilylethoxy)propan-2-ol (CID 23048068) is 1-(1-trimethylsilylethoxy)propan-2-ol.
What is the SMILES notation for 1-(1-trimethylsilylethoxy)propan-2-ol?
The canonical SMILES for 1-(1-trimethylsilylethoxy)propan-2-ol is CC(O)COC(C)[Si](C)(C)C.
What is the InChIKey of 1-(1-trimethylsilylethoxy)propan-2-ol?
The InChIKey is IBBKALRSRYYXEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20O2Si/c1-7(9)6-10-8(2)11(3,4)5/h7-9H,6H2,1-5H3.
What are the key properties of 1-(1-trimethylsilylethoxy)propan-2-ol?
1-(1-trimethylsilylethoxy)propan-2-ol has a molecular weight of 176.33 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-trimethylsilylethoxy)propan-2-ol is sourced from PubChem (CID 23048068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).