(4-chloro-2,7-dimethyl-1H-indol-3-yl)acetic acid
TL;DR: (4-chloro-2,7-dimethyl-1H-indol-3-yl)acetic acid (CAS 105908-44-9) is a chemical compound with molecular formula C12H12ClNO2 and molecular weight 237.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chloro-2,7-dimethyl-1H-indol-3-yl)acetic acid
Also Known As: (4-chloro-2,7-dimethyl-1H-indol-3-yl)acetic acid, 2-(4-chloro-2,7-dimethyl-1H-indol-3-yl)acetic Acid, (4-chloro-2,7-dimethyl-indol-3-yl)-acetic acid, (4-chloro-2,7-dimethyl-1H-indol-3-yl)aceticacid, (4-Chlor-2,7-dimethyl-indol-3-yl)-essigsaeure
| Molecular Formula | C12H12ClNO2 |
|---|---|
| Molecular Weight | 237.06 g/mol |
| LogP | 3.06524 |
| Topological Polar Surface Area | 53.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 237.05565 |
| Heavy Atoms | 16 |
| Complexity | 571.8927 |
Chemical Identifiers
| CAS Number | 105908-44-9 |
|---|---|
| SMILES | CC1=C2C(=C(C=C1)Cl)C(=C(N2)C)CC(=O)O |
Product Overview
(4-chloro-2,7-dimethyl-1H-indol-3-yl)acetic acid (CAS 105908-44-9), with molecular formula C12H12ClNO2 and molecular weight 237.06 g/mol. IUPAC: 2-(4-chloro-2,7-dimethyl-1H-indol-3-yl)acetic acid.
Chemical Property Profile of (4-chloro-2,7-dimethyl-1H-indol-3-yl)acetic acid
Property Insights of (4-chloro-2,7-dimethyl-1H-indol-3-yl)acetic acid
The XLogP value of 3.06524 indicates that (4-chloro-2,7-dimethyl-1H-indol-3-yl)acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.09 Ų, (4-chloro-2,7-dimethyl-1H-indol-3-yl)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-chloro-2,7-dimethyl-1H-indol-3-yl)acetic acid has 2 hydrogen bond donor(s) and 1 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 (4-chloro-2,7-dimethyl-1H-indol-3-yl)acetic acid?
The CAS number of (4-chloro-2,7-dimethyl-1H-indol-3-yl)acetic acid is 105908-44-9.
What is the molecular formula of (4-chloro-2,7-dimethyl-1H-indol-3-yl)acetic acid?
The molecular formula of (4-chloro-2,7-dimethyl-1H-indol-3-yl)acetic acid is C12H12ClNO2.
What is the molecular weight of (4-chloro-2,7-dimethyl-1H-indol-3-yl)acetic acid?
The molecular weight of (4-chloro-2,7-dimethyl-1H-indol-3-yl)acetic acid is 237.06 g/mol.
Where can I buy (4-chloro-2,7-dimethyl-1H-indol-3-yl)acetic acid?
You can request a quote for (4-chloro-2,7-dimethyl-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 (4-chloro-2,7-dimethyl-1H-indol-3-yl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (4-chloro-2,7-dimethyl-1H-indol-3-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.