2-氧代乙磺酸
TL;DR: 2-氧代乙磺酸 (CAS 37706-08-4) is a chemical compound with molecular formula C2H4O4S and molecular weight 123.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-氧代乙磺酸
2-oxoethanesulfonic acid
Also Known As: Sulfoacetaldehyde, 2-oxoethanesulfonic acid, 2-Sulfoacetaldehyde, 2-oxoethanesulfonate, 2-Oxoethane-1-sulfonic acid
| Molecular Formula | C2H4O4S |
|---|---|
| Molecular Weight | 123.98 g/mol |
| LogP | -1.4 |
| Topological Polar Surface Area | 79.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 123.98303 |
| Heavy Atoms | 7 |
| Complexity | 138.0 |
Chemical Identifiers
| CAS Number | 37706-08-4 |
|---|---|
| SMILES | C(C=O)S(=O)(=O)O |
| InChIKey | JTJIXCMSHWPJJE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-氧代乙磺酸 (CAS 37706-08-4), with molecular formula C2H4O4S and molecular weight 123.98 g/mol. IUPAC: 2-oxoethanesulfonic acid.
Chemical Property Profile of 2-氧代乙磺酸
Property Insights of 2-氧代乙磺酸
The XLogP value of -1.4 indicates that 2-氧代乙磺酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 79.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-氧代乙磺酸. Following Lipinski's Rule of Five, 2-氧代乙磺酸 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 2-氧代乙磺酸?
The CAS number of 2-氧代乙磺酸 is 37706-08-4.
What is the molecular formula of 2-氧代乙磺酸?
The molecular formula of 2-氧代乙磺酸 is C2H4O4S.
What is the molecular weight of 2-氧代乙磺酸?
The molecular weight of 2-氧代乙磺酸 is 123.98 g/mol.
Where can I buy 2-氧代乙磺酸?
You can request a quote for 2-氧代乙磺酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-氧代乙磺酸?
Yes, KEHONG BIO provides custom synthesis services for 2-氧代乙磺酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.