tert-butyl-[(3-fluorooxetan-3-yl)methoxy]-diphenylsilane

C20H25FO2Si — CID 138971939

IUPACtert-butyl-[(3-fluorooxetan-3-yl)methoxy]-diphenylsilane
SMILESCC(C)(C)[Si](OCC1(F)COC1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H25FO2Si/c1-19(2,3)24(17-10-6-4-7-11-17,18-12-8-5-9-13-18)23-16-20(21)14-22-15-20/h4-13H,14-16H2,1-3H3
InChIKeyLQGXITWPXFJTSE-UHFFFAOYSA-N
MW344.50 g/mol
LogP3.30
Rot. Bonds5

About tert-butyl-[(3-fluorooxetan-3-yl)methoxy]-diphenylsilane

tert-butyl-[(3-fluorooxetan-3-yl)methoxy]-diphenylsilane (PubChem CID 138971939) has the molecular formula C20H25FO2Si and a molecular weight of 344.50 g/mol. Its IUPAC name is tert-butyl-[(3-fluorooxetan-3-yl)methoxy]-diphenylsilane.

Molecular Properties

Compound Nametert-butyl-[(3-fluorooxetan-3-yl)methoxy]-diphenylsilane
PubChem CID138971939
Molecular FormulaC20H25FO2Si
Molecular Weight344.50 g/mol
Exact Mass344.16
IUPAC Nametert-butyl-[(3-fluorooxetan-3-yl)methoxy]-diphenylsilane
SMILESCC(C)(C)[Si](OCC1(F)COC1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H25FO2Si/c1-19(2,3)24(17-10-6-4-7-11-17,18-12-8-5-9-13-18)23-16-20(21)14-22-15-20/h4-13H,14-16H2,1-3H3
InChIKeyLQGXITWPXFJTSE-UHFFFAOYSA-N
XLogP3.30
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.50
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze tert-butyl-[(3-fluorooxetan-3-yl)methoxy]-diphenylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(3-fluorooxetan-3-yl)methoxy]-diphenylsilane?
The IUPAC name of tert-butyl-[(3-fluorooxetan-3-yl)methoxy]-diphenylsilane (CID 138971939) is tert-butyl-[(3-fluorooxetan-3-yl)methoxy]-diphenylsilane.
What is the SMILES notation for tert-butyl-[(3-fluorooxetan-3-yl)methoxy]-diphenylsilane?
The canonical SMILES for tert-butyl-[(3-fluorooxetan-3-yl)methoxy]-diphenylsilane is CC(C)(C)[Si](OCC1(F)COC1)(c1ccccc1)c1ccccc1.
What is the InChIKey of tert-butyl-[(3-fluorooxetan-3-yl)methoxy]-diphenylsilane?
The InChIKey is LQGXITWPXFJTSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25FO2Si/c1-19(2,3)24(17-10-6-4-7-11-17,18-12-8-5-9-13-18)23-16-20(21)14-22-15-20/h4-13H,14-16H2,1-3H3.
What are the key properties of tert-butyl-[(3-fluorooxetan-3-yl)methoxy]-diphenylsilane?
tert-butyl-[(3-fluorooxetan-3-yl)methoxy]-diphenylsilane has a molecular weight of 344.50 g/mol, XLogP of 3.30, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(3-fluorooxetan-3-yl)methoxy]-diphenylsilane is sourced from PubChem (CID 138971939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).