4-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol

C11H26O2Si — CID 72951988

IUPAC4-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol
SMILESCC(CCO)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H26O2Si/c1-10(7-8-12)9-13-14(5,6)11(2,3)4/h10,12H,7-9H2,1-6H3
InChIKeyDQTSYCMXYFOBLF-UHFFFAOYSA-N
MW218.41 g/mol
LogP3.03
Rot. Bonds5

About 4-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol

4-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol (PubChem CID 72951988) has the molecular formula C11H26O2Si and a molecular weight of 218.41 g/mol. Its IUPAC name is 4-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol.

Molecular Properties

Compound Name4-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol
PubChem CID72951988
Molecular FormulaC11H26O2Si
Molecular Weight218.41 g/mol
Exact Mass218.17
IUPAC Name4-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol
SMILESCC(CCO)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H26O2Si/c1-10(7-8-12)9-13-14(5,6)11(2,3)4/h10,12H,7-9H2,1-6H3
InChIKeyDQTSYCMXYFOBLF-UHFFFAOYSA-N
XLogP3.03
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.41
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 4-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol?
The IUPAC name of 4-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol (CID 72951988) is 4-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol.
What is the SMILES notation for 4-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol?
The canonical SMILES for 4-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol is CC(CCO)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of 4-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol?
The InChIKey is DQTSYCMXYFOBLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26O2Si/c1-10(7-8-12)9-13-14(5,6)11(2,3)4/h10,12H,7-9H2,1-6H3.
What are the key properties of 4-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol?
4-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol has a molecular weight of 218.41 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol is sourced from PubChem (CID 72951988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).