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Isobutylisopropyldimethoxysilane structure
Fine Chemical

Isobutylisopropyldimethoxysilane

TL;DR: Isobutylisopropyldimethoxysilane (CAS 111439-76-0) is a chemical compound with molecular formula C9H22O2Si and molecular weight 190.1389 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

dimethoxy-(2-methylpropyl)-propan-2-ylsilane

Also Known As: Isobutylisopropyldimethoxysilane, isobutyl(isopropyl)dimethoxysilane, dimethoxy-(2-methylpropyl)-propan-2-ylsilane, dimethoxyisobutylisopropylsilane, isopropylisobutyldimethoxysilane

CAS Number
111439-76-0
Molecular Formula
C9H22O2Si
Molecular Weight
190.1389 g/mol
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Application Areas

Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.

Catalysts (88 patents) Coatings & Adhesives (2 patents) Lubricants & Additives (6 patents) Organic Building Blocks (5 patents) Organometallic Reagents (10 patents)

Technical Specifications

Molecular FormulaC9H22O2Si
Molecular Weight190.1389 g/mol
XLogP2.79
Topological Polar Surface Area (TPSA)18.5 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds5
Exact Mass190.1389 Da
Heavy Atoms12
Complexity120.0
SMILESCC(C)C[Si](C(C)C)(OC)OC
InChIKeyXFAOZKNGVLIXLC-UHFFFAOYSA-N

Chemical Property Profile of Isobutylisopropyldimethoxysilane

XLogP
2.79
TPSA (Topological Polar Surface Area)
18.5
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
5
Heavy Atoms
12
Complexity
120.0
Exact Mass
190.1389
Monoisotopic Mass
190.1389
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Isobutylisopropyldimethoxysilane

The XLogP value of 2.79 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isobutylisopropyldimethoxysilane. With a topological polar surface area (TPSA) of 18.5 Ų, Isobutylisopropyldimethoxysilane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isobutylisopropyldimethoxysilane has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Isobutylisopropyldimethoxysilane?

The CAS number of Isobutylisopropyldimethoxysilane is 111439-76-0.

What is the molecular formula of Isobutylisopropyldimethoxysilane?

The molecular formula of Isobutylisopropyldimethoxysilane is C9H22O2Si.

What is the molecular weight of Isobutylisopropyldimethoxysilane?

The molecular weight of Isobutylisopropyldimethoxysilane is 190.1389 g/mol.

Where can I buy Isobutylisopropyldimethoxysilane?

You can request a quote for Isobutylisopropyldimethoxysilane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Isobutylisopropyldimethoxysilane?

Yes, CoreyChem provides custom synthesis services for Isobutylisopropyldimethoxysilane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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