3-(三氯锡基)丙酸丁酯
TL;DR: 3-(三氯锡基)丙酸丁酯 (CAS 61470-34-6) is a chemical compound with molecular formula C7H13Cl3O2Sn and molecular weight 353.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(三氯锡基)丙酸丁酯
butyl 3-trichlorostannylpropanoate
Also Known As: butyl3- propionate, Butyl 3-(trichlorostannyl)propionate, butyl 3-(trichlorostannyl)propanoate, butyl 3-trichlorostannylpropanoate, 3-(Trichlorostannyl)propanoic acid, butyl ester
| Molecular Formula | C7H13Cl3O2Sn |
|---|---|
| Molecular Weight | 353.90 g/mol |
| LogP | 3.38 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 353.90033 |
| Heavy Atoms | 13 |
| Complexity | 158.0 |
Chemical Identifiers
| CAS Number | 61470-34-6 |
|---|---|
| SMILES | CCCCOC(=O)CC[Sn](Cl)(Cl)Cl |
| InChIKey | KKIZJTLMVRCRAA-UHFFFAOYSA-K |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(三氯锡基)丙酸丁酯 (CAS 61470-34-6), with molecular formula C7H13Cl3O2Sn and molecular weight 353.90 g/mol. IUPAC: butyl 3-trichlorostannylpropanoate.
Chemical Property Profile of 3-(三氯锡基)丙酸丁酯
Property Insights of 3-(三氯锡基)丙酸丁酯
The XLogP value of 3.38 indicates that 3-(三氯锡基)丙酸丁酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 3-(三氯锡基)丙酸丁酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(三氯锡基)丙酸丁酯 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 3-(三氯锡基)丙酸丁酯?
The CAS number of 3-(三氯锡基)丙酸丁酯 is 61470-34-6.
What is the molecular formula of 3-(三氯锡基)丙酸丁酯?
The molecular formula of 3-(三氯锡基)丙酸丁酯 is C7H13Cl3O2Sn.
What is the molecular weight of 3-(三氯锡基)丙酸丁酯?
The molecular weight of 3-(三氯锡基)丙酸丁酯 is 353.90 g/mol.
Where can I buy 3-(三氯锡基)丙酸丁酯?
You can request a quote for 3-(三氯锡基)丙酸丁酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(三氯锡基)丙酸丁酯?
Yes, KEHONG BIO provides custom synthesis services for 3-(三氯锡基)丙酸丁酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.