Aceticc acid, 2-(methylthio)-, 2,5-dioxo-1-pyrrolidinyl ester
TL;DR: Aceticc acid, 2-(methylthio)-, 2,5-dioxo-1-pyrrolidinyl ester (CAS 54580-47-1) is a chemical compound with molecular formula C7H9NO4S and molecular weight 203.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,5-dioxopyrrolidin-1-yl) 2-methylsulfanylacetate
Also Known As: Succinimidyl methylmercaptoacetate, KST-1B5363, N-succinimidyl 2-methylthioacetate, (2,5-dioxopyrrolidin-1-yl) 2-methylsulfanylacetate, 1-{[(methylsulfanyl)acetyl]oxy}pyrrolidine-2,5-dione
| Molecular Formula | C7H9NO4S |
|---|---|
| Molecular Weight | 203.03 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 89.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 203.02522 |
| Heavy Atoms | 13 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 54580-47-1 |
|---|---|
| SMILES | CSCC(=O)ON1C(=O)CCC1=O |
| InChIKey | JQUYACFIADHYOD-UHFFFAOYSA-N |
Product Overview
Aceticc acid, 2-(methylthio)-, 2,5-dioxo-1-pyrrolidinyl ester (CAS 54580-47-1), with molecular formula C7H9NO4S and molecular weight 203.03 g/mol. IUPAC: (2,5-dioxopyrrolidin-1-yl) 2-methylsulfanylacetate.
Chemical Property Profile of Aceticc acid, 2-(methylthio)-, 2,5-dioxo-1-pyrrolidinyl ester
Property Insights of Aceticc acid, 2-(methylthio)-, 2,5-dioxo-1-pyrrolidinyl ester
The XLogP value of -0.1 indicates that Aceticc acid, 2-(methylthio)-, 2,5-dioxo-1-pyrrolidinyl ester is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 89.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Aceticc acid, 2-(methylthio)-, 2,5-dioxo-1-pyrrolidinyl ester. Following Lipinski's Rule of Five, Aceticc acid, 2-(methylthio)-, 2,5-dioxo-1-pyrrolidinyl ester has 0 hydrogen bond donor(s) and 5 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 Aceticc acid, 2-(methylthio)-, 2,5-dioxo-1-pyrrolidinyl ester?
The CAS number of Aceticc acid, 2-(methylthio)-, 2,5-dioxo-1-pyrrolidinyl ester is 54580-47-1.
What is the molecular formula of Aceticc acid, 2-(methylthio)-, 2,5-dioxo-1-pyrrolidinyl ester?
The molecular formula of Aceticc acid, 2-(methylthio)-, 2,5-dioxo-1-pyrrolidinyl ester is C7H9NO4S.
What is the molecular weight of Aceticc acid, 2-(methylthio)-, 2,5-dioxo-1-pyrrolidinyl ester?
The molecular weight of Aceticc acid, 2-(methylthio)-, 2,5-dioxo-1-pyrrolidinyl ester is 203.03 g/mol.
Where can I buy Aceticc acid, 2-(methylthio)-, 2,5-dioxo-1-pyrrolidinyl ester?
You can request a quote for Aceticc acid, 2-(methylthio)-, 2,5-dioxo-1-pyrrolidinyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aceticc acid, 2-(methylthio)-, 2,5-dioxo-1-pyrrolidinyl ester?
Yes, KEHONG BIO provides custom synthesis services for Aceticc acid, 2-(methylthio)-, 2,5-dioxo-1-pyrrolidinyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.