2-(2,6-dimethoxyphenyl)-2-trimethylsilylethanol

C13H22O3Si — CID 175454438

IUPAC2-(2,6-dimethoxyphenyl)-2-trimethylsilylethanol
SMILESCOc1cccc(OC)c1C(CO)[Si](C)(C)C
InChIInChI=1S/C13H22O3Si/c1-15-10-7-6-8-11(16-2)13(10)12(9-14)17(3,4)5/h6-8,12,14H,9H2,1-5H3
InChIKeyWUKIMMKNELOEGT-UHFFFAOYSA-N
MW254.40 g/mol
LogP2.66
Rot. Bonds5

About 2-(2,6-dimethoxyphenyl)-2-trimethylsilylethanol

2-(2,6-dimethoxyphenyl)-2-trimethylsilylethanol (PubChem CID 175454438) has the molecular formula C13H22O3Si and a molecular weight of 254.40 g/mol. Its IUPAC name is 2-(2,6-dimethoxyphenyl)-2-trimethylsilylethanol.

Molecular Properties

Compound Name2-(2,6-dimethoxyphenyl)-2-trimethylsilylethanol
PubChem CID175454438
Molecular FormulaC13H22O3Si
Molecular Weight254.40 g/mol
Exact Mass254.13
IUPAC Name2-(2,6-dimethoxyphenyl)-2-trimethylsilylethanol
SMILESCOc1cccc(OC)c1C(CO)[Si](C)(C)C
InChIInChI=1S/C13H22O3Si/c1-15-10-7-6-8-11(16-2)13(10)12(9-14)17(3,4)5/h6-8,12,14H,9H2,1-5H3
InChIKeyWUKIMMKNELOEGT-UHFFFAOYSA-N
XLogP2.66
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.40
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(fluoromethyl)-6-methoxyphenyl]propan-1-ol
CID 117287951
2-(1-amino-2-hydroxyethyl)-3-methoxyphenol
CID 77129655
(2S)-2-amino-2-(2-methoxy-6-methylphenyl)ethanol
CID 638516
1-(2-fluoro-6-methoxyphenyl)ethane-1,2-diol
CID 146455332
2-(2-methoxy-6-methylsulfanylphenyl)propan-1-ol
CID 117303266
1-(2,6-dimethoxyphenyl)-2-(2-methoxyphenyl)ethanol
CID 63018829
(3R)-3-amino-3-(2,6-dimethoxyphenyl)propan-1-ol;hydrochloride
CID 171201207
2-[1-(2-fluoro-6-methoxyphenyl)ethylamino]propane-1,3-diol
CID 112700459
[2-(hydroxymethyl)-6-methoxyphenyl]-(4-methoxyphenyl)methanol
CID 15548223
1-(2,6-dimethoxyphenyl)-4-phenylbutan-1-ol
CID 115791096
(2-(111C)methoxyphenyl)methanol
CID 59897789
2-(1-chloroethyl)-1,3-dimethoxybenzene
CID 130480511

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethoxyphenyl)-2-trimethylsilylethanol?
The IUPAC name of 2-(2,6-dimethoxyphenyl)-2-trimethylsilylethanol (CID 175454438) is 2-(2,6-dimethoxyphenyl)-2-trimethylsilylethanol.
What is the SMILES notation for 2-(2,6-dimethoxyphenyl)-2-trimethylsilylethanol?
The canonical SMILES for 2-(2,6-dimethoxyphenyl)-2-trimethylsilylethanol is COc1cccc(OC)c1C(CO)[Si](C)(C)C.
What is the InChIKey of 2-(2,6-dimethoxyphenyl)-2-trimethylsilylethanol?
The InChIKey is WUKIMMKNELOEGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22O3Si/c1-15-10-7-6-8-11(16-2)13(10)12(9-14)17(3,4)5/h6-8,12,14H,9H2,1-5H3.
What are the key properties of 2-(2,6-dimethoxyphenyl)-2-trimethylsilylethanol?
2-(2,6-dimethoxyphenyl)-2-trimethylsilylethanol has a molecular weight of 254.40 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethoxyphenyl)-2-trimethylsilylethanol is sourced from PubChem (CID 175454438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).