RefChem:570870
TL;DR: RefChem:570870 (CAS 68413-48-9) is a chemical compound with molecular formula C28H55O6PS2 and molecular weight 582.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dibutyl 2-[bis(2-ethylhexoxy)phosphinothioylsulfanyl]butanedioate
Also Known As: Dibutyl [[bis[(2-ethylhexyl)oxy]phosphinothioyl]thio]succinate, Butanedioic acid, ((bis((2-ethylhexyl)oxy)phosphinothioyl)thio)-, dibutyl ester, dibutyl((bis((2-ethylhexyl)oxy)phosphinothioyl)thio)succinate, Butanedioic acid, [[bis[(2-ethylhexyl)oxy]phosphinothioyl]thio]-, dibutyl ester, Dibutyl ((bis((2-ethylhexyl)oxy)phosphinothioyl)thio)succinate
| Molecular Formula | C28H55O6PS2 |
|---|---|
| Molecular Weight | 582.32 g/mol |
| LogP | 10.2 |
| Topological Polar Surface Area | 128.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 27 |
| Exact Mass | 582.31775 |
| Heavy Atoms | 37 |
| Complexity | 610.0 |
Chemical Identifiers
| CAS Number | 68413-48-9 |
|---|---|
| SMILES | CCCCC(CC)COP(=S)(OCC(CC)CCCC)SC(CC(=O)OCCCC)C(=O)OCCCC |
| InChIKey | DHEMFBSSQAFTOU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:570870 (CAS 68413-48-9), with molecular formula C28H55O6PS2 and molecular weight 582.32 g/mol. IUPAC: dibutyl 2-[bis(2-ethylhexoxy)phosphinothioylsulfanyl]butanedioate.
Chemical Property Profile of RefChem:570870
Property Insights of RefChem:570870
The XLogP value of 10.2 indicates that RefChem:570870 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:570870. Following Lipinski's Rule of Five, RefChem:570870 has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:570870?
The CAS number of RefChem:570870 is 68413-48-9.
What is the molecular formula of RefChem:570870?
The molecular formula of RefChem:570870 is C28H55O6PS2.
What is the molecular weight of RefChem:570870?
The molecular weight of RefChem:570870 is 582.32 g/mol.
Where can I buy RefChem:570870?
You can request a quote for RefChem:570870 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:570870?
Yes, KEHONG BIO provides custom synthesis services for RefChem:570870 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.