[4-[tert-butyl(dimethyl)silyl]-2-fluorophenyl]methanol

C13H21FOSi — CID 139673225

IUPAC[4-[tert-butyl(dimethyl)silyl]-2-fluorophenyl]methanol
SMILESCC(C)(C)[Si](C)(C)c1ccc(CO)c(F)c1
InChIInChI=1S/C13H21FOSi/c1-13(2,3)16(4,5)11-7-6-10(9-15)12(14)8-11/h6-8,15H,9H2,1-5H3
InChIKeyRCGIJTDPIBLKGB-UHFFFAOYSA-N
MW240.39 g/mol
LogP3.03
Rot. Bonds2

About [4-[tert-butyl(dimethyl)silyl]-2-fluorophenyl]methanol

[4-[tert-butyl(dimethyl)silyl]-2-fluorophenyl]methanol (PubChem CID 139673225) has the molecular formula C13H21FOSi and a molecular weight of 240.39 g/mol. Its IUPAC name is [4-[tert-butyl(dimethyl)silyl]-2-fluorophenyl]methanol.

Molecular Properties

Compound Name[4-[tert-butyl(dimethyl)silyl]-2-fluorophenyl]methanol
PubChem CID139673225
Molecular FormulaC13H21FOSi
Molecular Weight240.39 g/mol
Exact Mass240.13
IUPAC Name[4-[tert-butyl(dimethyl)silyl]-2-fluorophenyl]methanol
SMILESCC(C)(C)[Si](C)(C)c1ccc(CO)c(F)c1
InChIInChI=1S/C13H21FOSi/c1-13(2,3)16(4,5)11-7-6-10(9-15)12(14)8-11/h6-8,15H,9H2,1-5H3
InChIKeyRCGIJTDPIBLKGB-UHFFFAOYSA-N
XLogP3.03
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 [4-[tert-butyl(dimethyl)silyl]-2-fluorophenyl]methanol?
The IUPAC name of [4-[tert-butyl(dimethyl)silyl]-2-fluorophenyl]methanol (CID 139673225) is [4-[tert-butyl(dimethyl)silyl]-2-fluorophenyl]methanol.
What is the SMILES notation for [4-[tert-butyl(dimethyl)silyl]-2-fluorophenyl]methanol?
The canonical SMILES for [4-[tert-butyl(dimethyl)silyl]-2-fluorophenyl]methanol is CC(C)(C)[Si](C)(C)c1ccc(CO)c(F)c1.
What is the InChIKey of [4-[tert-butyl(dimethyl)silyl]-2-fluorophenyl]methanol?
The InChIKey is RCGIJTDPIBLKGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21FOSi/c1-13(2,3)16(4,5)11-7-6-10(9-15)12(14)8-11/h6-8,15H,9H2,1-5H3.
What are the key properties of [4-[tert-butyl(dimethyl)silyl]-2-fluorophenyl]methanol?
[4-[tert-butyl(dimethyl)silyl]-2-fluorophenyl]methanol has a molecular weight of 240.39 g/mol, XLogP of 3.03, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[tert-butyl(dimethyl)silyl]-2-fluorophenyl]methanol is sourced from PubChem (CID 139673225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).