alpha-Hydroxy-1H-indole-3-ethanesulfonic acid
TL;DR: alpha-Hydroxy-1H-indole-3-ethanesulfonic acid (CAS 2000-57-9) is a chemical compound with molecular formula C10H11NO4S and molecular weight 241.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hydroxy-2-(1H-indol-3-yl)ethanesulfonic acid
Also Known As: indole-3-acetaldehyde, alpha-Hydroxy-1H-indole-3-ethanesulfonic acid, 1-hydroxy-2-(1H-indol-3-yl)ethanesulfonic Acid, 1-Hydroxy-2-(1H-Indol-3-Yl)Ethane-1-Sulfonic Acid, RefChem:318414
| Molecular Formula | C10H11NO4S |
|---|---|
| Molecular Weight | 241.04 g/mol |
| LogP | 0.9166 |
| Topological Polar Surface Area | 90.39 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 241.04088 |
| Heavy Atoms | 16 |
| Complexity | 602.06146 |
Chemical Identifiers
| CAS Number | 2000-57-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)CC(O)S(=O)(=O)O |
Product Overview
alpha-Hydroxy-1H-indole-3-ethanesulfonic acid (CAS 2000-57-9), with molecular formula C10H11NO4S and molecular weight 241.04 g/mol. IUPAC: 1-hydroxy-2-(1H-indol-3-yl)ethanesulfonic acid.
Chemical Property Profile of alpha-Hydroxy-1H-indole-3-ethanesulfonic acid
Property Insights of alpha-Hydroxy-1H-indole-3-ethanesulfonic acid
The XLogP value of 0.9166 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-Hydroxy-1H-indole-3-ethanesulfonic acid. The TPSA of 90.39 Ų falls within the moderate polarity range, balancing permeability and solubility for alpha-Hydroxy-1H-indole-3-ethanesulfonic acid. Following Lipinski's Rule of Five, alpha-Hydroxy-1H-indole-3-ethanesulfonic acid has 3 hydrogen bond donor(s) and 3 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 alpha-Hydroxy-1H-indole-3-ethanesulfonic acid?
The CAS number of alpha-Hydroxy-1H-indole-3-ethanesulfonic acid is 2000-57-9.
What is the molecular formula of alpha-Hydroxy-1H-indole-3-ethanesulfonic acid?
The molecular formula of alpha-Hydroxy-1H-indole-3-ethanesulfonic acid is C10H11NO4S.
What is the molecular weight of alpha-Hydroxy-1H-indole-3-ethanesulfonic acid?
The molecular weight of alpha-Hydroxy-1H-indole-3-ethanesulfonic acid is 241.04 g/mol.
Where can I buy alpha-Hydroxy-1H-indole-3-ethanesulfonic acid?
You can request a quote for alpha-Hydroxy-1H-indole-3-ethanesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Hydroxy-1H-indole-3-ethanesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for alpha-Hydroxy-1H-indole-3-ethanesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.