2-氧-3-亚磺酰丙酸
TL;DR: 2-氧-3-亚磺酰丙酸 (CAS 88947-38-0) is a chemical compound with molecular formula C3H4O5S and molecular weight 151.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-氧-3-亚磺酰丙酸
2-oxo-3-sulfinopropanoic acid
Also Known As: 3-sulfinylpyruvic acid, 3-Sulfinopyruvate, 3-Sulfinylpyruvate, b-sulfinyl pyruvate, 2-oxo-3-sulfinopropanoic acid
| Molecular Formula | C3H4O5S |
|---|---|
| Molecular Weight | 151.98 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 151.97795 |
| Heavy Atoms | 9 |
| Complexity | 162.0 |
Chemical Identifiers
| CAS Number | 88947-38-0 |
|---|---|
| SMILES | C(C(=O)C(=O)O)S(=O)O |
| InChIKey | JXYLQEMXCAAMOL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-氧-3-亚磺酰丙酸 (CAS 88947-38-0), with molecular formula C3H4O5S and molecular weight 151.98 g/mol. IUPAC: 2-oxo-3-sulfinopropanoic acid.
Chemical Property Profile of 2-氧-3-亚磺酰丙酸
Property Insights of 2-氧-3-亚磺酰丙酸
The XLogP value of -1.0 indicates that 2-氧-3-亚磺酰丙酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-氧-3-亚磺酰丙酸. Following Lipinski's Rule of Five, 2-氧-3-亚磺酰丙酸 has 2 hydrogen bond donor(s) and 6 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-3-亚磺酰丙酸?
The CAS number of 2-氧-3-亚磺酰丙酸 is 88947-38-0.
What is the molecular formula of 2-氧-3-亚磺酰丙酸?
The molecular formula of 2-氧-3-亚磺酰丙酸 is C3H4O5S.
What is the molecular weight of 2-氧-3-亚磺酰丙酸?
The molecular weight of 2-氧-3-亚磺酰丙酸 is 151.98 g/mol.
Where can I buy 2-氧-3-亚磺酰丙酸?
You can request a quote for 2-氧-3-亚磺酰丙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-氧-3-亚磺酰丙酸?
Yes, KEHONG BIO provides custom synthesis services for 2-氧-3-亚磺酰丙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.