1,2-二硫戊环-4-甲酸
TL;DR: 1,2-二硫戊环-4-甲酸 (CAS 2224-02-4) is a chemical compound with molecular formula C4H6O2S2 and molecular weight 149.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-二硫戊环-4-甲酸
dithiolane-4-carboxylic acid
Also Known As: Asparagusic acid, 1,2-DITHIOLANE-4-CARBOXYLIC ACID, Asparagusate, dithiolane-4-carboxylic acid, Asparagusicacid
| Molecular Formula | C4H6O2S2 |
|---|---|
| Molecular Weight | 149.98 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 87.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 149.98093 |
| Heavy Atoms | 8 |
| Complexity | 98.0 |
| Melting Point | 75.7 - 76.5 °C |
Chemical Identifiers
| CAS Number | 2224-02-4 |
|---|---|
| SMILES | C1C(CSS1)C(=O)O |
| InChIKey | AYGMEFRECNWRJC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-二硫戊环-4-甲酸 (CAS 2224-02-4), with molecular formula C4H6O2S2 and molecular weight 149.98 g/mol. IUPAC: dithiolane-4-carboxylic acid.
Chemical Property Profile of 1,2-二硫戊环-4-甲酸
Property Insights of 1,2-二硫戊环-4-甲酸
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-二硫戊环-4-甲酸. The TPSA of 87.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-二硫戊环-4-甲酸. Following Lipinski's Rule of Five, 1,2-二硫戊环-4-甲酸 has 1 hydrogen bond donor(s) and 4 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 1,2-二硫戊环-4-甲酸?
The CAS number of 1,2-二硫戊环-4-甲酸 is 2224-02-4.
What is the molecular formula of 1,2-二硫戊环-4-甲酸?
The molecular formula of 1,2-二硫戊环-4-甲酸 is C4H6O2S2.
What is the molecular weight of 1,2-二硫戊环-4-甲酸?
The molecular weight of 1,2-二硫戊环-4-甲酸 is 149.98 g/mol.
Where can I buy 1,2-二硫戊环-4-甲酸?
You can request a quote for 1,2-二硫戊环-4-甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-二硫戊环-4-甲酸?
Yes, KEHONG BIO provides custom synthesis services for 1,2-二硫戊环-4-甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.