Trimethylsilyl 3-bromobutanoate
TL;DR: Trimethylsilyl 3-bromobutanoate (CAS 18301-67-2) is a chemical compound with molecular formula C7H15BrO2Si and molecular weight 238.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethylsilyl 3-bromobutanoate
Also Known As: Trimethylsilyl 3-bromobutanoate, 3-Bromobutyric acid trimethylsilyl ester, Trimethylsilyl 3-bromobutanoate #, 3-Bromobutyric acid, TMS derivative, Butyric acid, 3-bromo-, trimethylsilyl ester
| Molecular Formula | C7H15BrO2Si |
|---|---|
| Molecular Weight | 238.00 g/mol |
| LogP | 2.538 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 238.00247 |
| Heavy Atoms | 11 |
| Complexity | 142.0 |
Chemical Identifiers
| CAS Number | 18301-67-2 |
|---|---|
| SMILES | CC(CC(=O)O[Si](C)(C)C)Br |
| InChIKey | LBKUIBRAAQFCQC-UHFFFAOYSA-N |
Product Overview
Trimethylsilyl 3-bromobutanoate (CAS 18301-67-2), with molecular formula C7H15BrO2Si and molecular weight 238.00 g/mol. IUPAC: trimethylsilyl 3-bromobutanoate.
Chemical Property Profile of Trimethylsilyl 3-bromobutanoate
Property Insights of Trimethylsilyl 3-bromobutanoate
The XLogP value of 2.538 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trimethylsilyl 3-bromobutanoate. With a topological polar surface area (TPSA) of 26.3 Ų, Trimethylsilyl 3-bromobutanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Trimethylsilyl 3-bromobutanoate 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 Trimethylsilyl 3-bromobutanoate?
The CAS number of Trimethylsilyl 3-bromobutanoate is 18301-67-2.
What is the molecular formula of Trimethylsilyl 3-bromobutanoate?
The molecular formula of Trimethylsilyl 3-bromobutanoate is C7H15BrO2Si.
What is the molecular weight of Trimethylsilyl 3-bromobutanoate?
The molecular weight of Trimethylsilyl 3-bromobutanoate is 238.00 g/mol.
Where can I buy Trimethylsilyl 3-bromobutanoate?
You can request a quote for Trimethylsilyl 3-bromobutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trimethylsilyl 3-bromobutanoate?
Yes, KEHONG BIO provides custom synthesis services for Trimethylsilyl 3-bromobutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.