butoxy-dimethyl-phenylsilane

C12H20OSi — CID 606298

IUPACbutoxy-dimethyl-phenylsilane
SMILESCCCCO[Si](C)(C)c1ccccc1
InChIInChI=1S/C12H20OSi/c1-4-5-11-13-14(2,3)12-9-7-6-8-10-12/h6-10H,4-5,11H2,1-3H3
InChIKeyOXCVIKPUIPWUGG-UHFFFAOYSA-N
MW208.38 g/mol
LogP2.92
Rot. Bonds5

About butoxy-dimethyl-phenylsilane

butoxy-dimethyl-phenylsilane (PubChem CID 606298) has the molecular formula C12H20OSi and a molecular weight of 208.38 g/mol. Its IUPAC name is butoxy-dimethyl-phenylsilane.

Molecular Properties

Compound Namebutoxy-dimethyl-phenylsilane
PubChem CID606298
Molecular FormulaC12H20OSi
Molecular Weight208.38 g/mol
Exact Mass208.13
IUPAC Namebutoxy-dimethyl-phenylsilane
SMILESCCCCO[Si](C)(C)c1ccccc1
InChIInChI=1S/C12H20OSi/c1-4-5-11-13-14(2,3)12-9-7-6-8-10-12/h6-10H,4-5,11H2,1-3H3
InChIKeyOXCVIKPUIPWUGG-UHFFFAOYSA-N
XLogP2.92
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.38
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze butoxy-dimethyl-phenylsilane 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 butoxy-dimethyl-phenylsilane?
The IUPAC name of butoxy-dimethyl-phenylsilane (CID 606298) is butoxy-dimethyl-phenylsilane.
What is the SMILES notation for butoxy-dimethyl-phenylsilane?
The canonical SMILES for butoxy-dimethyl-phenylsilane is CCCCO[Si](C)(C)c1ccccc1.
What is the InChIKey of butoxy-dimethyl-phenylsilane?
The InChIKey is OXCVIKPUIPWUGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20OSi/c1-4-5-11-13-14(2,3)12-9-7-6-8-10-12/h6-10H,4-5,11H2,1-3H3.
What are the key properties of butoxy-dimethyl-phenylsilane?
butoxy-dimethyl-phenylsilane has a molecular weight of 208.38 g/mol, XLogP of 2.92, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butoxy-dimethyl-phenylsilane is sourced from PubChem (CID 606298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).