ditert-butyl(fluoro)silane

C8H19FSi — CID 71444727

IUPACditert-butyl(fluoro)silane
SMILESCC(C)(C)[SiH](F)C(C)(C)C
InChIInChI=1S/C8H19FSi/c1-7(2,3)10(9)8(4,5)6/h10H,1-6H3
InChIKeyNHISJVVPMDFYGD-UHFFFAOYSA-N
MW162.32 g/mol
LogP3.28
Rot. Bonds

About ditert-butyl(fluoro)silane

ditert-butyl(fluoro)silane (PubChem CID 71444727) has the molecular formula C8H19FSi and a molecular weight of 162.32 g/mol. Its IUPAC name is ditert-butyl(fluoro)silane.

Molecular Properties

Compound Nameditert-butyl(fluoro)silane
PubChem CID71444727
Molecular FormulaC8H19FSi
Molecular Weight162.32 g/mol
Exact Mass162.12
IUPAC Nameditert-butyl(fluoro)silane
SMILESCC(C)(C)[SiH](F)C(C)(C)C
InChIInChI=1S/C8H19FSi/c1-7(2,3)10(9)8(4,5)6/h10H,1-6H3
InChIKeyNHISJVVPMDFYGD-UHFFFAOYSA-N
XLogP3.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.32
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze ditert-butyl(fluoro)silane 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 ditert-butyl(fluoro)silane?
The IUPAC name of ditert-butyl(fluoro)silane (CID 71444727) is ditert-butyl(fluoro)silane.
What is the SMILES notation for ditert-butyl(fluoro)silane?
The canonical SMILES for ditert-butyl(fluoro)silane is CC(C)(C)[SiH](F)C(C)(C)C.
What is the InChIKey of ditert-butyl(fluoro)silane?
The InChIKey is NHISJVVPMDFYGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19FSi/c1-7(2,3)10(9)8(4,5)6/h10H,1-6H3.
What are the key properties of ditert-butyl(fluoro)silane?
ditert-butyl(fluoro)silane has a molecular weight of 162.32 g/mol, XLogP of 3.28, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ditert-butyl(fluoro)silane is sourced from PubChem (CID 71444727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).