[2-[dimethyl-(4-methylsulfanylphenyl)silyl]phenyl]methanol

C16H20OSSi — CID 57416883

IUPAC[2-[dimethyl-(4-methylsulfanylphenyl)silyl]phenyl]methanol
SMILESCSc1ccc([Si](C)(C)c2ccccc2CO)cc1
InChIInChI=1S/C16H20OSSi/c1-18-14-8-10-15(11-9-14)19(2,3)16-7-5-4-6-13(16)12-17/h4-11,17H,12H2,1-3H3
InChIKeyGYMHMHLSZBSCIM-UHFFFAOYSA-N
MW288.49 g/mol
LogP2.72
Rot. Bonds4

About [2-[dimethyl-(4-methylsulfanylphenyl)silyl]phenyl]methanol

[2-[dimethyl-(4-methylsulfanylphenyl)silyl]phenyl]methanol (PubChem CID 57416883) has the molecular formula C16H20OSSi and a molecular weight of 288.49 g/mol. Its IUPAC name is [2-[dimethyl-(4-methylsulfanylphenyl)silyl]phenyl]methanol.

Molecular Properties

Compound Name[2-[dimethyl-(4-methylsulfanylphenyl)silyl]phenyl]methanol
PubChem CID57416883
Molecular FormulaC16H20OSSi
Molecular Weight288.49 g/mol
Exact Mass288.10
IUPAC Name[2-[dimethyl-(4-methylsulfanylphenyl)silyl]phenyl]methanol
SMILESCSc1ccc([Si](C)(C)c2ccccc2CO)cc1
InChIInChI=1S/C16H20OSSi/c1-18-14-8-10-15(11-9-14)19(2,3)16-7-5-4-6-13(16)12-17/h4-11,17H,12H2,1-3H3
InChIKeyGYMHMHLSZBSCIM-UHFFFAOYSA-N
XLogP2.72
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.49
LogP ≤ 52.72
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 [2-[dimethyl-(4-methylsulfanylphenyl)silyl]phenyl]methanol?
The IUPAC name of [2-[dimethyl-(4-methylsulfanylphenyl)silyl]phenyl]methanol (CID 57416883) is [2-[dimethyl-(4-methylsulfanylphenyl)silyl]phenyl]methanol.
What is the SMILES notation for [2-[dimethyl-(4-methylsulfanylphenyl)silyl]phenyl]methanol?
The canonical SMILES for [2-[dimethyl-(4-methylsulfanylphenyl)silyl]phenyl]methanol is CSc1ccc([Si](C)(C)c2ccccc2CO)cc1.
What is the InChIKey of [2-[dimethyl-(4-methylsulfanylphenyl)silyl]phenyl]methanol?
The InChIKey is GYMHMHLSZBSCIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20OSSi/c1-18-14-8-10-15(11-9-14)19(2,3)16-7-5-4-6-13(16)12-17/h4-11,17H,12H2,1-3H3.
What are the key properties of [2-[dimethyl-(4-methylsulfanylphenyl)silyl]phenyl]methanol?
[2-[dimethyl-(4-methylsulfanylphenyl)silyl]phenyl]methanol has a molecular weight of 288.49 g/mol, XLogP of 2.72, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[dimethyl-(4-methylsulfanylphenyl)silyl]phenyl]methanol is sourced from PubChem (CID 57416883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).