2-Hydroxyethyl benzenesulfonate
TL;DR: 2-Hydroxyethyl benzenesulfonate (CAS 249285-50-5) is a chemical compound with molecular formula C8H10O4S and molecular weight 202.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxyethyl benzenesulfonate
Also Known As: 2-hydroxyethyl benzenesulfonate, 2-hydroxythyl benzenesulfohate, 1-Benzenesulfonate 1,2-Ethanediol, 1,2-Ethanediol, 1-benzenesulfonate, NCIOpen2_003154
| Molecular Formula | C8H10O4S |
|---|---|
| Molecular Weight | 202.03 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 72.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 202.02998 |
| Heavy Atoms | 13 |
| Complexity | 223.0 |
Chemical Identifiers
| CAS Number | 249285-50-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)OCCO |
| InChIKey | BJFRCYIYQLHUDS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Hydroxyethyl benzenesulfonate (CAS 249285-50-5), with molecular formula C8H10O4S and molecular weight 202.03 g/mol. IUPAC: 2-hydroxyethyl benzenesulfonate.
Chemical Property Profile of 2-Hydroxyethyl benzenesulfonate
Property Insights of 2-Hydroxyethyl benzenesulfonate
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hydroxyethyl benzenesulfonate. The TPSA of 72.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Hydroxyethyl benzenesulfonate. Following Lipinski's Rule of Five, 2-Hydroxyethyl benzenesulfonate 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-Hydroxyethyl benzenesulfonate?
The CAS number of 2-Hydroxyethyl benzenesulfonate is 249285-50-5.
What is the molecular formula of 2-Hydroxyethyl benzenesulfonate?
The molecular formula of 2-Hydroxyethyl benzenesulfonate is C8H10O4S.
What is the molecular weight of 2-Hydroxyethyl benzenesulfonate?
The molecular weight of 2-Hydroxyethyl benzenesulfonate is 202.03 g/mol.
Where can I buy 2-Hydroxyethyl benzenesulfonate?
You can request a quote for 2-Hydroxyethyl benzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxyethyl benzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxyethyl benzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.