Butanedioic acid, ((2-((diethoxyphosphinyl)thio)ethyl)thio)-, dimethyl ester
TL;DR: Butanedioic acid, ((2-((diethoxyphosphinyl)thio)ethyl)thio)-, dimethyl ester (CAS 63234-04-8) is a chemical compound with molecular formula C12H23O7PS2 and molecular weight 374.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-(2-diethoxyphosphorylsulfanylethylsulfanyl)butanedioate
Also Known As: Butanedioic acid, ((2-((diethoxyphosphinyl)thio)ethyl)thio)-, dimethyl ester, dimethyl 2-(2-diethoxyphosphorylsulfanylethylsulfanyl)butanedioate, Dimethyl 2-({2-[(diethoxyphosphoryl)sulfanyl]ethyl}sulfanyl)butanedioate, 1,4-dimethyl 2-({2-[(diethoxyphosphoryl)sulfanyl]ethyl}sulfanyl)butanedioate, Thiophosphoric acid S-[2-[1,2-bis(methoxycarbonyl)ethylthio]ethyl]O,O-diethyl ester
| Molecular Formula | C12H23O7PS2 |
|---|---|
| Molecular Weight | 374.06 g/mol |
| LogP | 2.7386 |
| Topological Polar Surface Area | 88.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 374.0623 |
| Heavy Atoms | 22 |
| Complexity | 381.67105 |
Chemical Identifiers
| CAS Number | 63234-04-8 |
|---|---|
| SMILES | CCOP(=O)(OCC)SCCSC(CC(=O)OC)C(=O)OC |
Product Overview
Butanedioic acid, ((2-((diethoxyphosphinyl)thio)ethyl)thio)-, dimethyl ester (CAS 63234-04-8), with molecular formula C12H23O7PS2 and molecular weight 374.06 g/mol. IUPAC: dimethyl 2-(2-diethoxyphosphorylsulfanylethylsulfanyl)butanedioate.
Chemical Property Profile of Butanedioic acid, ((2-((diethoxyphosphinyl)thio)ethyl)thio)-, dimethyl ester
Property Insights of Butanedioic acid, ((2-((diethoxyphosphinyl)thio)ethyl)thio)-, dimethyl ester
The XLogP value of 2.7386 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butanedioic acid, ((2-((diethoxyphosphinyl)thio)ethyl)thio)-, dimethyl ester. The TPSA of 88.13 Ų falls within the moderate polarity range, balancing permeability and solubility for Butanedioic acid, ((2-((diethoxyphosphinyl)thio)ethyl)thio)-, dimethyl ester. Following Lipinski's Rule of Five, Butanedioic acid, ((2-((diethoxyphosphinyl)thio)ethyl)thio)-, dimethyl ester has 0 hydrogen bond donor(s) and 9 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 Butanedioic acid, ((2-((diethoxyphosphinyl)thio)ethyl)thio)-, dimethyl ester?
The CAS number of Butanedioic acid, ((2-((diethoxyphosphinyl)thio)ethyl)thio)-, dimethyl ester is 63234-04-8.
What is the molecular formula of Butanedioic acid, ((2-((diethoxyphosphinyl)thio)ethyl)thio)-, dimethyl ester?
The molecular formula of Butanedioic acid, ((2-((diethoxyphosphinyl)thio)ethyl)thio)-, dimethyl ester is C12H23O7PS2.
What is the molecular weight of Butanedioic acid, ((2-((diethoxyphosphinyl)thio)ethyl)thio)-, dimethyl ester?
The molecular weight of Butanedioic acid, ((2-((diethoxyphosphinyl)thio)ethyl)thio)-, dimethyl ester is 374.06 g/mol.
Where can I buy Butanedioic acid, ((2-((diethoxyphosphinyl)thio)ethyl)thio)-, dimethyl ester?
You can request a quote for Butanedioic acid, ((2-((diethoxyphosphinyl)thio)ethyl)thio)-, dimethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanedioic acid, ((2-((diethoxyphosphinyl)thio)ethyl)thio)-, dimethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Butanedioic acid, ((2-((diethoxyphosphinyl)thio)ethyl)thio)-, dimethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.