tert-butyl-dimethyl-(2-propylphenoxy)silane

C15H26OSi — CID 11196040

IUPACtert-butyl-dimethyl-(2-propylphenoxy)silane
SMILESCCCc1ccccc1O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H26OSi/c1-7-10-13-11-8-9-12-14(13)16-17(5,6)15(2,3)4/h8-9,11-12H,7,10H2,1-6H3
InChIKeyJYKRDOBMUZPMDM-UHFFFAOYSA-N
MW250.46 g/mol
LogP5.02
Rot. Bonds4

About tert-butyl-dimethyl-(2-propylphenoxy)silane

tert-butyl-dimethyl-(2-propylphenoxy)silane (PubChem CID 11196040) has the molecular formula C15H26OSi and a molecular weight of 250.46 g/mol. Its IUPAC name is tert-butyl-dimethyl-(2-propylphenoxy)silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(2-propylphenoxy)silane
PubChem CID11196040
Molecular FormulaC15H26OSi
Molecular Weight250.46 g/mol
Exact Mass250.18
IUPAC Nametert-butyl-dimethyl-(2-propylphenoxy)silane
SMILESCCCc1ccccc1O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H26OSi/c1-7-10-13-11-8-9-12-14(13)16-17(5,6)15(2,3)4/h8-9,11-12H,7,10H2,1-6H3
InChIKeyJYKRDOBMUZPMDM-UHFFFAOYSA-N
XLogP5.02
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500250.46
LogP ≤ 55.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze tert-butyl-dimethyl-(2-propylphenoxy)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 tert-butyl-dimethyl-(2-propylphenoxy)silane?
The IUPAC name of tert-butyl-dimethyl-(2-propylphenoxy)silane (CID 11196040) is tert-butyl-dimethyl-(2-propylphenoxy)silane.
What is the SMILES notation for tert-butyl-dimethyl-(2-propylphenoxy)silane?
The canonical SMILES for tert-butyl-dimethyl-(2-propylphenoxy)silane is CCCc1ccccc1O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-(2-propylphenoxy)silane?
The InChIKey is JYKRDOBMUZPMDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26OSi/c1-7-10-13-11-8-9-12-14(13)16-17(5,6)15(2,3)4/h8-9,11-12H,7,10H2,1-6H3.
What are the key properties of tert-butyl-dimethyl-(2-propylphenoxy)silane?
tert-butyl-dimethyl-(2-propylphenoxy)silane has a molecular weight of 250.46 g/mol, XLogP of 5.02, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(2-propylphenoxy)silane is sourced from PubChem (CID 11196040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).