tert-Butyl o-trimethylsilylphenyl sulfone
TL;DR: tert-Butyl o-trimethylsilylphenyl sulfone (CAS 118335-07-2) is a chemical compound with molecular formula C13H22O2SSi and molecular weight 270.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-tert-butylsulfonylphenyl)-trimethylsilane
Also Known As: tert-Butyl o-trimethylsilylphenyl sulfone, (2-tert-butylsulfonylphenyl)-trimethylsilane, tert-Butyl[2-(trimethylsilyl)phenyl] sulfone, Silane, [2-[(1,1-dimethylethyl)sulfonyl]phenyl]trimethyl-, [2-(tert-Butylsulfonyl)phenyl](trimethyl)silane #
| Molecular Formula | C13H22O2SSi |
|---|---|
| Molecular Weight | 270.11 g/mol |
| LogP | 2.804 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 270.111 |
| Heavy Atoms | 17 |
| Complexity | 354.0 |
Chemical Identifiers
| CAS Number | 118335-07-2 |
|---|---|
| SMILES | CC(C)(C)S(=O)(=O)C1=CC=CC=C1[Si](C)(C)C |
| InChIKey | KOPIXLZPIUYYMN-UHFFFAOYSA-N |
Product Overview
tert-Butyl o-trimethylsilylphenyl sulfone (CAS 118335-07-2), with molecular formula C13H22O2SSi and molecular weight 270.11 g/mol. IUPAC: (2-tert-butylsulfonylphenyl)-trimethylsilane.
Chemical Property Profile of tert-Butyl o-trimethylsilylphenyl sulfone
Property Insights of tert-Butyl o-trimethylsilylphenyl sulfone
The XLogP value of 2.804 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-Butyl o-trimethylsilylphenyl sulfone. With a topological polar surface area (TPSA) of 42.5 Ų, tert-Butyl o-trimethylsilylphenyl sulfone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tert-Butyl o-trimethylsilylphenyl sulfone 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
Frequently Asked Questions
What is the CAS number of tert-Butyl o-trimethylsilylphenyl sulfone?
The CAS number of tert-Butyl o-trimethylsilylphenyl sulfone is 118335-07-2.
What is the molecular formula of tert-Butyl o-trimethylsilylphenyl sulfone?
The molecular formula of tert-Butyl o-trimethylsilylphenyl sulfone is C13H22O2SSi.
What is the molecular weight of tert-Butyl o-trimethylsilylphenyl sulfone?
The molecular weight of tert-Butyl o-trimethylsilylphenyl sulfone is 270.11 g/mol.
Where can I buy tert-Butyl o-trimethylsilylphenyl sulfone?
You can request a quote for tert-Butyl o-trimethylsilylphenyl sulfone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tert-Butyl o-trimethylsilylphenyl sulfone?
Yes, KEHONG BIO provides custom synthesis services for tert-Butyl o-trimethylsilylphenyl sulfone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.