(6-Chloro-2-methyl-1h-indol-3-yl)acetic acid
TL;DR: (6-Chloro-2-methyl-1h-indol-3-yl)acetic acid (CAS 61725-93-7) is a chemical compound with molecular formula C11H10ClNO2 and molecular weight 223.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(6-chloro-2-methyl-1H-indol-3-yl)acetic acid
Also Known As: (6-chloro-2-methyl-1h-indol-3-yl)acetic acid, KST-1A6554, 2-(6-chloro-2-methyl-1H-indol-3-yl)acetic acid, (6-chloro-2-methyl-indol-3-yl)-acetic acid, Indole-3-acetic acid, 6-chloro-2-methyl-
| Molecular Formula | C11H10ClNO2 |
|---|---|
| Molecular Weight | 223.04 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 53.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 223.04001 |
| Heavy Atoms | 15 |
| Complexity | 259.0 |
Chemical Identifiers
| CAS Number | 61725-93-7 |
|---|---|
| SMILES | CC1=C(C2=C(N1)C=C(C=C2)Cl)CC(=O)O |
| InChIKey | CRCFIUIKYLJTBK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(6-Chloro-2-methyl-1h-indol-3-yl)acetic acid (CAS 61725-93-7), with molecular formula C11H10ClNO2 and molecular weight 223.04 g/mol. IUPAC: 2-(6-chloro-2-methyl-1H-indol-3-yl)acetic acid.
Chemical Property Profile of (6-Chloro-2-methyl-1h-indol-3-yl)acetic acid
Property Insights of (6-Chloro-2-methyl-1h-indol-3-yl)acetic acid
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (6-Chloro-2-methyl-1h-indol-3-yl)acetic acid. With a topological polar surface area (TPSA) of 53.1 Ų, (6-Chloro-2-methyl-1h-indol-3-yl)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (6-Chloro-2-methyl-1h-indol-3-yl)acetic acid has 2 hydrogen bond donor(s) and 2 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 (6-Chloro-2-methyl-1h-indol-3-yl)acetic acid?
The CAS number of (6-Chloro-2-methyl-1h-indol-3-yl)acetic acid is 61725-93-7.
What is the molecular formula of (6-Chloro-2-methyl-1h-indol-3-yl)acetic acid?
The molecular formula of (6-Chloro-2-methyl-1h-indol-3-yl)acetic acid is C11H10ClNO2.
What is the molecular weight of (6-Chloro-2-methyl-1h-indol-3-yl)acetic acid?
The molecular weight of (6-Chloro-2-methyl-1h-indol-3-yl)acetic acid is 223.04 g/mol.
Where can I buy (6-Chloro-2-methyl-1h-indol-3-yl)acetic acid?
You can request a quote for (6-Chloro-2-methyl-1h-indol-3-yl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (6-Chloro-2-methyl-1h-indol-3-yl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (6-Chloro-2-methyl-1h-indol-3-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.