1-Hydroxy-1,3-propanedisulfonic acid
TL;DR: 1-Hydroxy-1,3-propanedisulfonic acid (CAS 35850-94-3) is a chemical compound with molecular formula C3H8O7S2 and molecular weight 219.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hydroxypropane-1,3-disulfonic acid
Also Known As: 1-Hydroxy-1,3-propanedisulfonic acid, 1-hydroxypropane-1,3-disulfonic acid, 1-hydroxy-propane-1,3-disulfonic acid,sodium-salt
| Molecular Formula | C3H8O7S2 |
|---|---|
| Molecular Weight | 219.97 g/mol |
| LogP | -2.2 |
| Topological Polar Surface Area | 146.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 219.97115 |
| Heavy Atoms | 12 |
| Complexity | 313.0 |
Chemical Identifiers
| CAS Number | 35850-94-3 |
|---|---|
| SMILES | C(CS(=O)(=O)O)C(O)S(=O)(=O)O |
| InChIKey | PFEHYGDNXTWNDD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Hydroxy-1,3-propanedisulfonic acid (CAS 35850-94-3), with molecular formula C3H8O7S2 and molecular weight 219.97 g/mol. IUPAC: 1-hydroxypropane-1,3-disulfonic acid.
Chemical Property Profile of 1-Hydroxy-1,3-propanedisulfonic acid
Property Insights of 1-Hydroxy-1,3-propanedisulfonic acid
The XLogP value of -2.2 indicates that 1-Hydroxy-1,3-propanedisulfonic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 146.0 Ų indicates high polarity, suggesting 1-Hydroxy-1,3-propanedisulfonic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-Hydroxy-1,3-propanedisulfonic 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 1-Hydroxy-1,3-propanedisulfonic acid?
The CAS number of 1-Hydroxy-1,3-propanedisulfonic acid is 35850-94-3.
What is the molecular formula of 1-Hydroxy-1,3-propanedisulfonic acid?
The molecular formula of 1-Hydroxy-1,3-propanedisulfonic acid is C3H8O7S2.
What is the molecular weight of 1-Hydroxy-1,3-propanedisulfonic acid?
The molecular weight of 1-Hydroxy-1,3-propanedisulfonic acid is 219.97 g/mol.
Where can I buy 1-Hydroxy-1,3-propanedisulfonic acid?
You can request a quote for 1-Hydroxy-1,3-propanedisulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Hydroxy-1,3-propanedisulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-Hydroxy-1,3-propanedisulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.