sodium oxido-oxo-phenylmethoxysilane

C7H7NaO3Si — CID 23707396

IUPACsodium oxido-oxo-phenylmethoxysilane
SMILESO=[Si]([O-])OCc1ccccc1.[Na+]
InChIInChI=1S/C7H7O3Si.Na/c8-11(9)10-6-7-4-2-1-3-5-7;/h1-5H,6H2;/q-1;+1
InChIKeyPOBNKNYBUVKPOP-UHFFFAOYSA-N
MW190.21 g/mol
LogP-3.02
Rot. Bonds3

About sodium oxido-oxo-phenylmethoxysilane

sodium oxido-oxo-phenylmethoxysilane (PubChem CID 23707396) has the molecular formula C7H7NaO3Si and a molecular weight of 190.21 g/mol. Its IUPAC name is sodium oxido-oxo-phenylmethoxysilane.

Molecular Properties

Compound Namesodium oxido-oxo-phenylmethoxysilane
PubChem CID23707396
Molecular FormulaC7H7NaO3Si
Molecular Weight190.21 g/mol
Exact Mass190.01
IUPAC Namesodium oxido-oxo-phenylmethoxysilane
SMILESO=[Si]([O-])OCc1ccccc1.[Na+]
InChIInChI=1S/C7H7O3Si.Na/c8-11(9)10-6-7-4-2-1-3-5-7;/h1-5H,6H2;/q-1;+1
InChIKeyPOBNKNYBUVKPOP-UHFFFAOYSA-N
XLogP-3.02
TPSA49.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.21
LogP ≤ 5-3.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

disodium;phenylmethoxymethylbenzene;sulfate
CID 70513406
disodium bis(oxido-oxo-phenylmethoxyphosphanium)
CID 171808155
sodium phenylmethoxyarsinate
CID 174995318
2-phenylmethoxyprop-2-enoic acid
CID 14954752
CID 174906307
CID 174906307
CID 66734377
CID 66734377
sodium;O-benzyl carbamothioate;carbamothioate
CID 166769787
N-methyl-1-phenylmethoxymethanimidate
CID 123332537
benzyl carbonochloridate
CID 10387
benzyl phenylmethoxycarbonyl carbonate
CID 3649378
benzyl carbamate;heptahydrochloride
CID 141351835
benzyl acetate
CID 8785

Frequently Asked Questions

What is the IUPAC name of sodium oxido-oxo-phenylmethoxysilane?
The IUPAC name of sodium oxido-oxo-phenylmethoxysilane (CID 23707396) is sodium oxido-oxo-phenylmethoxysilane.
What is the SMILES notation for sodium oxido-oxo-phenylmethoxysilane?
The canonical SMILES for sodium oxido-oxo-phenylmethoxysilane is O=[Si]([O-])OCc1ccccc1.[Na+].
What is the InChIKey of sodium oxido-oxo-phenylmethoxysilane?
The InChIKey is POBNKNYBUVKPOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7O3Si.Na/c8-11(9)10-6-7-4-2-1-3-5-7;/h1-5H,6H2;/q-1;+1.
What are the key properties of sodium oxido-oxo-phenylmethoxysilane?
sodium oxido-oxo-phenylmethoxysilane has a molecular weight of 190.21 g/mol, XLogP of -3.02, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for sodium oxido-oxo-phenylmethoxysilane is sourced from PubChem (CID 23707396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).