RefChem:77616
TL;DR: RefChem:77616 (CAS 53202-61-2) is a chemical compound with molecular formula C30H60O4S2Sn and molecular weight 668.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylhexyl 3-[dibutyl-[3-(2-ethylhexoxy)-3-oxopropyl]sulfanylstannyl]sulfanylpropanoate
Also Known As: EINECS 258-428-0, Dibutyltinbis(2-ethylhexyl 3-mercaptopropionate), 2-Ethylhexyl 5,5-dibutyl-12-ethyl-9-oxo-10-oxa-4,6-dithia-5-stannahexadecanoate, 10-Oxa-4,6-dithia-5-stannahexadecanoic acid, 5,5-dibutyl-12-ethyl-9-oxo-, 2-ethylhexyl ester, 2-ethylhexyl 3-[dibutyl-[3-(2-ethylhexoxy)-3-oxopropyl]sulfa
| Molecular Formula | C30H60O4S2Sn |
|---|---|
| Molecular Weight | 668.30 g/mol |
| LogP | 9.7946 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 26 |
| Exact Mass | 668.29553 |
| Heavy Atoms | 37 |
| Complexity | 513.69946 |
Chemical Identifiers
| CAS Number | 53202-61-2 |
|---|---|
| SMILES | CCCCC(CC)COC(=O)CCS[Sn](CCCC)(CCCC)SCCC(=O)OCC(CC)CCCC |
Product Overview
RefChem:77616 (CAS 53202-61-2), with molecular formula C30H60O4S2Sn and molecular weight 668.30 g/mol. IUPAC: 2-ethylhexyl 3-[dibutyl-[3-(2-ethylhexoxy)-3-oxopropyl]sulfanylstannyl]sulfanylpropanoate.
Chemical Property Profile of RefChem:77616
Property Insights of RefChem:77616
The XLogP value of 9.7946 indicates that RefChem:77616 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, RefChem:77616 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:77616 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:77616?
The CAS number of RefChem:77616 is 53202-61-2.
What is the molecular formula of RefChem:77616?
The molecular formula of RefChem:77616 is C30H60O4S2Sn.
What is the molecular weight of RefChem:77616?
The molecular weight of RefChem:77616 is 668.30 g/mol.
Where can I buy RefChem:77616?
You can request a quote for RefChem:77616 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:77616?
Yes, KEHONG BIO provides custom synthesis services for RefChem:77616 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.