3-Sulphopropyl 3-hydroxypropane-1-sulphonate
TL;DR: 3-Sulphopropyl 3-hydroxypropane-1-sulphonate (CAS 79749-62-5) is a chemical compound with molecular formula C6H14O7S2 and molecular weight 262.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-hydroxypropylsulfonyloxy)propane-1-sulfonic acid
Also Known As: EINECS 279-249-4, 3-Sulphopropyl 3-hydroxypropane-1-sulphonate, 3-sulphopropyl3-hydroxypropane-1-sulphonate, 3-(3-hydroxypropylsulfonyloxy)propane-1-sulfonic acid, 3-SULFOPROPYL 3-HYDROXYPROPANE-1-SULFONATE
| Molecular Formula | C6H14O7S2 |
|---|---|
| Molecular Weight | 262.02 g/mol |
| LogP | -1.0069 |
| Topological Polar Surface Area | 117.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 262.0181 |
| Heavy Atoms | 15 |
| Complexity | 354.94165 |
Chemical Identifiers
| CAS Number | 79749-62-5 |
|---|---|
| SMILES | C(CO)CS(=O)(=O)OCCCS(=O)(=O)O |
Product Overview
3-Sulphopropyl 3-hydroxypropane-1-sulphonate (CAS 79749-62-5), with molecular formula C6H14O7S2 and molecular weight 262.02 g/mol. IUPAC: 3-(3-hydroxypropylsulfonyloxy)propane-1-sulfonic acid.
Chemical Property Profile of 3-Sulphopropyl 3-hydroxypropane-1-sulphonate
Property Insights of 3-Sulphopropyl 3-hydroxypropane-1-sulphonate
The XLogP value of -1.0069 indicates that 3-Sulphopropyl 3-hydroxypropane-1-sulphonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 117.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Sulphopropyl 3-hydroxypropane-1-sulphonate. Following Lipinski's Rule of Five, 3-Sulphopropyl 3-hydroxypropane-1-sulphonate 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 3-Sulphopropyl 3-hydroxypropane-1-sulphonate?
The CAS number of 3-Sulphopropyl 3-hydroxypropane-1-sulphonate is 79749-62-5.
What is the molecular formula of 3-Sulphopropyl 3-hydroxypropane-1-sulphonate?
The molecular formula of 3-Sulphopropyl 3-hydroxypropane-1-sulphonate is C6H14O7S2.
What is the molecular weight of 3-Sulphopropyl 3-hydroxypropane-1-sulphonate?
The molecular weight of 3-Sulphopropyl 3-hydroxypropane-1-sulphonate is 262.02 g/mol.
Where can I buy 3-Sulphopropyl 3-hydroxypropane-1-sulphonate?
You can request a quote for 3-Sulphopropyl 3-hydroxypropane-1-sulphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Sulphopropyl 3-hydroxypropane-1-sulphonate?
Yes, KEHONG BIO provides custom synthesis services for 3-Sulphopropyl 3-hydroxypropane-1-sulphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.