2-((2-Amino-2-carboxyethyl)dithio)benzoic acid
TL;DR: 2-((2-Amino-2-carboxyethyl)dithio)benzoic acid (CAS 55372-32-2) is a chemical compound with molecular formula C10H11NO4S2 and molecular weight 273.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-amino-2-carboxyethyl)disulfanyl]benzoic acid
Also Known As: 2-((2-Amino-2-carboxyethyl)dithio)benzoic acid, Benzoic acid, 2-[(2-amino-2-carboxyethyl)dithio]-, 2-[(2-amino-3-hydroxy-3-oxopropyl)disulfanyl]benzoic acid, 2-[(2-amino-3-hydroxy-3-oxo-propyl)disulfanyl]benzoic acid, Benzoic acid,2-[(2-amino-2-carboxyethyl)dithio]-, (r)-(9ci)
| Molecular Formula | C10H11NO4S2 |
|---|---|
| Molecular Weight | 273.01 g/mol |
| LogP | -1.6 |
| Topological Polar Surface Area | 151.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 273.01294 |
| Heavy Atoms | 17 |
| Complexity | 287.0 |
Chemical Identifiers
| CAS Number | 55372-32-2 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O)SSCC(C(=O)O)N |
| InChIKey | SYCGYWFLRDXWDE-UHFFFAOYSA-N |
Product Overview
2-((2-Amino-2-carboxyethyl)dithio)benzoic acid (CAS 55372-32-2), with molecular formula C10H11NO4S2 and molecular weight 273.01 g/mol. IUPAC: 2-[(2-amino-2-carboxyethyl)disulfanyl]benzoic acid.
Chemical Property Profile of 2-((2-Amino-2-carboxyethyl)dithio)benzoic acid
Property Insights of 2-((2-Amino-2-carboxyethyl)dithio)benzoic acid
The XLogP value of -1.6 indicates that 2-((2-Amino-2-carboxyethyl)dithio)benzoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 151.0 Ų indicates high polarity, suggesting 2-((2-Amino-2-carboxyethyl)dithio)benzoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-((2-Amino-2-carboxyethyl)dithio)benzoic acid has 3 hydrogen bond donor(s) and 7 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-((2-Amino-2-carboxyethyl)dithio)benzoic acid?
The CAS number of 2-((2-Amino-2-carboxyethyl)dithio)benzoic acid is 55372-32-2.
What is the molecular formula of 2-((2-Amino-2-carboxyethyl)dithio)benzoic acid?
The molecular formula of 2-((2-Amino-2-carboxyethyl)dithio)benzoic acid is C10H11NO4S2.
What is the molecular weight of 2-((2-Amino-2-carboxyethyl)dithio)benzoic acid?
The molecular weight of 2-((2-Amino-2-carboxyethyl)dithio)benzoic acid is 273.01 g/mol.
Where can I buy 2-((2-Amino-2-carboxyethyl)dithio)benzoic acid?
You can request a quote for 2-((2-Amino-2-carboxyethyl)dithio)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((2-Amino-2-carboxyethyl)dithio)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-((2-Amino-2-carboxyethyl)dithio)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.