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Acetic acid, 2,2'-[(phenylmethylene)bis(sulfonyl)]bis-, diethyl ester
TL;DR: Acetic acid, 2,2'-[(phenylmethylene)bis(sulfonyl)]bis-, diethyl ester (CAS 61713-32-4) is a chemical compound with molecular formula C15H20O8S2 and molecular weight 392.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(2-ethoxy-2-oxoethyl)sulfonyl-phenylmethyl]sulfonylacetate
Also Known As: BAS 00134171, UPCMLD0ENAT0500-1959:001, Acetic acid, 2,2'-[(phenylmethylene)bis(sulfonyl)]bis-, diethyl ester, AB01320158-02, Diethyl 2,2'-[(phenylmethylene)disulfonyl]diacetate
| Molecular Formula | C15H20O8S2 |
|---|---|
| Molecular Weight | 392.06 g/mol |
| LogP | 0.641 |
| Topological Polar Surface Area | 120.88 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 392.05997 |
| Heavy Atoms | 25 |
| Complexity | 747.19293 |
Chemical Identifiers
| CAS Number | 61713-32-4 |
|---|---|
| SMILES | CCOC(=O)CS(=O)(=O)C(C1=CC=CC=C1)S(=O)(=O)CC(=O)OCC |
Product Overview
Acetic acid, 2,2'-[(phenylmethylene)bis(sulfonyl)]bis-, diethyl ester (CAS 61713-32-4), with molecular formula C15H20O8S2 and molecular weight 392.06 g/mol. IUPAC: ethyl 2-[(2-ethoxy-2-oxoethyl)sulfonyl-phenylmethyl]sulfonylacetate.
Chemical Property Profile of Acetic acid, 2,2'-[(phenylmethylene)bis(sulfonyl)]bis-, diethyl ester
Property Insights of Acetic acid, 2,2'-[(phenylmethylene)bis(sulfonyl)]bis-, diethyl ester
The XLogP value of 0.641 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, 2,2'-[(phenylmethylene)bis(sulfonyl)]bis-, diethyl ester. The TPSA of 120.88 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid, 2,2'-[(phenylmethylene)bis(sulfonyl)]bis-, diethyl ester. Following Lipinski's Rule of Five, Acetic acid, 2,2'-[(phenylmethylene)bis(sulfonyl)]bis-, diethyl ester has 0 hydrogen bond donor(s) and 8 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 Acetic acid, 2,2'-[(phenylmethylene)bis(sulfonyl)]bis-, diethyl ester?
The CAS number of Acetic acid, 2,2'-[(phenylmethylene)bis(sulfonyl)]bis-, diethyl ester is 61713-32-4.
What is the molecular formula of Acetic acid, 2,2'-[(phenylmethylene)bis(sulfonyl)]bis-, diethyl ester?
The molecular formula of Acetic acid, 2,2'-[(phenylmethylene)bis(sulfonyl)]bis-, diethyl ester is C15H20O8S2.
What is the molecular weight of Acetic acid, 2,2'-[(phenylmethylene)bis(sulfonyl)]bis-, diethyl ester?
The molecular weight of Acetic acid, 2,2'-[(phenylmethylene)bis(sulfonyl)]bis-, diethyl ester is 392.06 g/mol.
Where can I buy Acetic acid, 2,2'-[(phenylmethylene)bis(sulfonyl)]bis-, diethyl ester?
You can request a quote for Acetic acid, 2,2'-[(phenylmethylene)bis(sulfonyl)]bis-, diethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, 2,2'-[(phenylmethylene)bis(sulfonyl)]bis-, diethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, 2,2'-[(phenylmethylene)bis(sulfonyl)]bis-, diethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.