1H-Indole-3-methanesulfonic acid
TL;DR: 1H-Indole-3-methanesulfonic acid (CAS 25177-75-7) is a chemical compound with molecular formula C9H9NO3S and molecular weight 211.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1H-indol-3-ylmethanesulfonic acid
Also Known As: 1H-Indole-3-methanesulfonic acid, indol-3-yl methanesulphonic acid, (1H-indol-3-yl)methanesulfonic acid, 1H-indol-3-ylmethanesulfonic acid, (1H-Indole-3-yl)methanesulfonic acid
| Molecular Formula | C9H9NO3S |
|---|---|
| Molecular Weight | 211.03 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 78.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 211.03032 |
| Heavy Atoms | 14 |
| Complexity | 296.0 |
Chemical Identifiers
| CAS Number | 25177-75-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)CS(=O)(=O)O |
| InChIKey | KGGXFLJSRHWJTP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-Indole-3-methanesulfonic acid (CAS 25177-75-7), with molecular formula C9H9NO3S and molecular weight 211.03 g/mol. IUPAC: 1H-indol-3-ylmethanesulfonic acid.
Chemical Property Profile of 1H-Indole-3-methanesulfonic acid
Property Insights of 1H-Indole-3-methanesulfonic acid
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Indole-3-methanesulfonic acid. The TPSA of 78.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Indole-3-methanesulfonic acid. Following Lipinski's Rule of Five, 1H-Indole-3-methanesulfonic acid has 2 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 1H-Indole-3-methanesulfonic acid?
The CAS number of 1H-Indole-3-methanesulfonic acid is 25177-75-7.
What is the molecular formula of 1H-Indole-3-methanesulfonic acid?
The molecular formula of 1H-Indole-3-methanesulfonic acid is C9H9NO3S.
What is the molecular weight of 1H-Indole-3-methanesulfonic acid?
The molecular weight of 1H-Indole-3-methanesulfonic acid is 211.03 g/mol.
Where can I buy 1H-Indole-3-methanesulfonic acid?
You can request a quote for 1H-Indole-3-methanesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Indole-3-methanesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 1H-Indole-3-methanesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.