tert-butyl(phenyl)silane

C10H16Si — CID 5142460

IUPACtert-butyl(phenyl)silane
SMILESCC(C)(C)[SiH2]c1ccccc1
InChIInChI=1S/C10H16Si/c1-10(2,3)11-9-7-5-4-6-8-9/h4-8H,11H2,1-3H3
InChIKeyLLBSSEQAXQNVPC-UHFFFAOYSA-N
MW164.32 g/mol
LogP1.70
Rot. Bonds1

About tert-butyl(phenyl)silane

tert-butyl(phenyl)silane (PubChem CID 5142460) has the molecular formula C10H16Si and a molecular weight of 164.32 g/mol. Its IUPAC name is tert-butyl(phenyl)silane.

Molecular Properties

Compound Nametert-butyl(phenyl)silane
PubChem CID5142460
Molecular FormulaC10H16Si
Molecular Weight164.32 g/mol
Exact Mass164.10
IUPAC Nametert-butyl(phenyl)silane
SMILESCC(C)(C)[SiH2]c1ccccc1
InChIInChI=1S/C10H16Si/c1-10(2,3)11-9-7-5-4-6-8-9/h4-8H,11H2,1-3H3
InChIKeyLLBSSEQAXQNVPC-UHFFFAOYSA-N
XLogP1.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.32
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 tert-butyl(phenyl)silane?
The IUPAC name of tert-butyl(phenyl)silane (CID 5142460) is tert-butyl(phenyl)silane.
What is the SMILES notation for tert-butyl(phenyl)silane?
The canonical SMILES for tert-butyl(phenyl)silane is CC(C)(C)[SiH2]c1ccccc1.
What is the InChIKey of tert-butyl(phenyl)silane?
The InChIKey is LLBSSEQAXQNVPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16Si/c1-10(2,3)11-9-7-5-4-6-8-9/h4-8H,11H2,1-3H3.
What are the key properties of tert-butyl(phenyl)silane?
tert-butyl(phenyl)silane has a molecular weight of 164.32 g/mol, XLogP of 1.70, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl(phenyl)silane is sourced from PubChem (CID 5142460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).