difluoro-hydroxy-phenoxysilane

C6H6F2O2Si — CID 149252797

IUPACdifluoro-hydroxy-phenoxysilane
SMILESO[Si](F)(F)Oc1ccccc1
InChIInChI=1S/C6H6F2O2Si/c7-11(8,9)10-6-4-2-1-3-5-6/h1-5,9H
InChIKeyBYJGBVXZJQHHFB-UHFFFAOYSA-N
MW176.19 g/mol
LogP1.43
Rot. Bonds2

About difluoro-hydroxy-phenoxysilane

difluoro-hydroxy-phenoxysilane (PubChem CID 149252797) has the molecular formula C6H6F2O2Si and a molecular weight of 176.19 g/mol. Its IUPAC name is difluoro-hydroxy-phenoxysilane.

Molecular Properties

Compound Namedifluoro-hydroxy-phenoxysilane
PubChem CID149252797
Molecular FormulaC6H6F2O2Si
Molecular Weight176.19 g/mol
Exact Mass176.01
IUPAC Namedifluoro-hydroxy-phenoxysilane
SMILESO[Si](F)(F)Oc1ccccc1
InChIInChI=1S/C6H6F2O2Si/c7-11(8,9)10-6-4-2-1-3-5-6/h1-5,9H
InChIKeyBYJGBVXZJQHHFB-UHFFFAOYSA-N
XLogP1.43
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.19
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of difluoro-hydroxy-phenoxysilane?
The IUPAC name of difluoro-hydroxy-phenoxysilane (CID 149252797) is difluoro-hydroxy-phenoxysilane.
What is the SMILES notation for difluoro-hydroxy-phenoxysilane?
The canonical SMILES for difluoro-hydroxy-phenoxysilane is O[Si](F)(F)Oc1ccccc1.
What is the InChIKey of difluoro-hydroxy-phenoxysilane?
The InChIKey is BYJGBVXZJQHHFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6F2O2Si/c7-11(8,9)10-6-4-2-1-3-5-6/h1-5,9H.
What are the key properties of difluoro-hydroxy-phenoxysilane?
difluoro-hydroxy-phenoxysilane has a molecular weight of 176.19 g/mol, XLogP of 1.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for difluoro-hydroxy-phenoxysilane is sourced from PubChem (CID 149252797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).