2-巯基甲基戊二酸
TL;DR: 2-巯基甲基戊二酸 (CAS 109333-27-9) is a chemical compound with molecular formula C6H10O4S and molecular weight 178.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-巯基甲基戊二酸
2-(sulfanylmethyl)pentanedioic acid
Also Known As: 2-Mercaptomethylglutaric acid, 2-Mmga, 2-(sulfanylmethyl)pentanedioic acid, 2-mer-captomethylglutaric acid, 2-Mercaptomethyl-pentanedioic acid
| Molecular Formula | C6H10O4S |
|---|---|
| Molecular Weight | 178.03 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 75.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 178.02998 |
| Heavy Atoms | 11 |
| Complexity | 157.0 |
Chemical Identifiers
| CAS Number | 109333-27-9 |
|---|---|
| SMILES | C(CC(=O)O)C(CS)C(=O)O |
| InChIKey | LDFDXRPEWZHIML-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-巯基甲基戊二酸 (CAS 109333-27-9), with molecular formula C6H10O4S and molecular weight 178.03 g/mol. IUPAC: 2-(sulfanylmethyl)pentanedioic acid.
Chemical Property Profile of 2-巯基甲基戊二酸
Property Insights of 2-巯基甲基戊二酸
The XLogP value of -0.1 indicates that 2-巯基甲基戊二酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-巯基甲基戊二酸. Following Lipinski's Rule of Five, 2-巯基甲基戊二酸 has 3 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 2-巯基甲基戊二酸?
The CAS number of 2-巯基甲基戊二酸 is 109333-27-9.
What is the molecular formula of 2-巯基甲基戊二酸?
The molecular formula of 2-巯基甲基戊二酸 is C6H10O4S.
What is the molecular weight of 2-巯基甲基戊二酸?
The molecular weight of 2-巯基甲基戊二酸 is 178.03 g/mol.
Where can I buy 2-巯基甲基戊二酸?
You can request a quote for 2-巯基甲基戊二酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-巯基甲基戊二酸?
Yes, KEHONG BIO provides custom synthesis services for 2-巯基甲基戊二酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.