(2S)-4-methoxy-4-phenyl-2-trimethylsilylbutan-2-ol

C14H24O2Si — CID 102301293

IUPAC(2S)-4-methoxy-4-phenyl-2-trimethylsilylbutan-2-ol
SMILESCOC(C[C@@](C)(O)[Si](C)(C)C)c1ccccc1
InChIInChI=1S/C14H24O2Si/c1-14(15,17(3,4)5)11-13(16-2)12-9-7-6-8-10-12/h6-10,13,15H,11H2,1-5H3/t13?,14-/m0/s1
InChIKeyACNXYLPNYIHQED-KZUDCZAMSA-N
MW252.43 g/mol
LogP3.39
Rot. Bonds5

About (2S)-4-methoxy-4-phenyl-2-trimethylsilylbutan-2-ol

(2S)-4-methoxy-4-phenyl-2-trimethylsilylbutan-2-ol (PubChem CID 102301293) has the molecular formula C14H24O2Si and a molecular weight of 252.43 g/mol. Its IUPAC name is (2S)-4-methoxy-4-phenyl-2-trimethylsilylbutan-2-ol.

Molecular Properties

Compound Name(2S)-4-methoxy-4-phenyl-2-trimethylsilylbutan-2-ol
PubChem CID102301293
Molecular FormulaC14H24O2Si
Molecular Weight252.43 g/mol
Exact Mass252.15
IUPAC Name(2S)-4-methoxy-4-phenyl-2-trimethylsilylbutan-2-ol
SMILESCOC(C[C@@](C)(O)[Si](C)(C)C)c1ccccc1
InChIInChI=1S/C14H24O2Si/c1-14(15,17(3,4)5)11-13(16-2)12-9-7-6-8-10-12/h6-10,13,15H,11H2,1-5H3/t13?,14-/m0/s1
InChIKeyACNXYLPNYIHQED-KZUDCZAMSA-N
XLogP3.39
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.43
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (2S)-4-methoxy-4-phenyl-2-trimethylsilylbutan-2-ol with MolForge

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

Launch Full Analysis

Related Compounds

(2R)-2-methoxy-2-phenylethanol
CID 6950345
benzene;[(1R)-1,2-dimethoxyethyl]benzene
CID 178156280
[(1S)-2-deuteriooxy-1-methoxyethyl]benzene
CID 140824843
3-methoxy-3-phenylpropanoic acid
CID 13379217
2-methyl-4-phenyl-4-propan-2-yloxybutan-2-ol
CID 142601392
[1-(3,3-dimethyl-1-phenylbutyl)peroxy-3,3-dimethylbutyl]benzene
CID 149433737
1,2-bis(2-methoxy-2-phenylethyl)benzene
CID 90884874
(2S,3S,4R,5S)-4-methoxy-3,5-diphenyl-2-trimethylsilylhexan-2-ol
CID 11348849
(2-benzylselanyl-1-methoxyethyl)benzene
CID 15257784
[(2R)-2-methoxy-2-phenylethyl] [(2S)-2-methoxy-2-phenylethyl] carbonate
CID 102443903
1-(2-methoxy-2-phenylethoxy)propan-2-ol
CID 59464511
[(1S)-2-ethoxy-1-methoxyethyl]benzene
CID 155459528

Frequently Asked Questions

What is the IUPAC name of (2S)-4-methoxy-4-phenyl-2-trimethylsilylbutan-2-ol?
The IUPAC name of (2S)-4-methoxy-4-phenyl-2-trimethylsilylbutan-2-ol (CID 102301293) is (2S)-4-methoxy-4-phenyl-2-trimethylsilylbutan-2-ol.
What is the SMILES notation for (2S)-4-methoxy-4-phenyl-2-trimethylsilylbutan-2-ol?
The canonical SMILES for (2S)-4-methoxy-4-phenyl-2-trimethylsilylbutan-2-ol is COC(C[C@@](C)(O)[Si](C)(C)C)c1ccccc1.
What is the InChIKey of (2S)-4-methoxy-4-phenyl-2-trimethylsilylbutan-2-ol?
The InChIKey is ACNXYLPNYIHQED-KZUDCZAMSA-N. The full InChI is InChI=1S/C14H24O2Si/c1-14(15,17(3,4)5)11-13(16-2)12-9-7-6-8-10-12/h6-10,13,15H,11H2,1-5H3/t13?,14-/m0/s1.
What are the key properties of (2S)-4-methoxy-4-phenyl-2-trimethylsilylbutan-2-ol?
(2S)-4-methoxy-4-phenyl-2-trimethylsilylbutan-2-ol has a molecular weight of 252.43 g/mol, XLogP of 3.39, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-4-methoxy-4-phenyl-2-trimethylsilylbutan-2-ol is sourced from PubChem (CID 102301293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).