1-Acetyl-6-chloro-2-methyl-1h-indol-3-yl acetate
TL;DR: 1-Acetyl-6-chloro-2-methyl-1h-indol-3-yl acetate (CAS 6307-33-1) is a chemical compound with molecular formula C13H12ClNO3 and molecular weight 265.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-acetyl-6-chloro-2-methylindol-3-yl) acetate
Also Known As: acetate, 1-acetyl-6-chloro-2-methyl-1h-indol-3-yl acetate, (1-acetyl-6-chloro-2-methylindol-3-yl) acetate, J2.740.985G, 1-Acetyl-2-methyl-3-acetoxy-6-chloro-1H-indole
| Molecular Formula | C13H12ClNO3 |
|---|---|
| Molecular Weight | 265.05 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 48.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 265.05057 |
| Heavy Atoms | 18 |
| Complexity | 360.0 |
Chemical Identifiers
| CAS Number | 6307-33-1 |
|---|---|
| SMILES | CC1=C(C2=C(N1C(=O)C)C=C(C=C2)Cl)OC(=O)C |
| InChIKey | AMJQQQTXFVFJHB-UHFFFAOYSA-N |
Product Overview
1-Acetyl-6-chloro-2-methyl-1h-indol-3-yl acetate (CAS 6307-33-1), with molecular formula C13H12ClNO3 and molecular weight 265.05 g/mol. IUPAC: (1-acetyl-6-chloro-2-methylindol-3-yl) acetate.
Chemical Property Profile of 1-Acetyl-6-chloro-2-methyl-1h-indol-3-yl acetate
Property Insights of 1-Acetyl-6-chloro-2-methyl-1h-indol-3-yl acetate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Acetyl-6-chloro-2-methyl-1h-indol-3-yl acetate. With a topological polar surface area (TPSA) of 48.3 Ų, 1-Acetyl-6-chloro-2-methyl-1h-indol-3-yl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Acetyl-6-chloro-2-methyl-1h-indol-3-yl acetate has 0 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 1-Acetyl-6-chloro-2-methyl-1h-indol-3-yl acetate?
The CAS number of 1-Acetyl-6-chloro-2-methyl-1h-indol-3-yl acetate is 6307-33-1.
What is the molecular formula of 1-Acetyl-6-chloro-2-methyl-1h-indol-3-yl acetate?
The molecular formula of 1-Acetyl-6-chloro-2-methyl-1h-indol-3-yl acetate is C13H12ClNO3.
What is the molecular weight of 1-Acetyl-6-chloro-2-methyl-1h-indol-3-yl acetate?
The molecular weight of 1-Acetyl-6-chloro-2-methyl-1h-indol-3-yl acetate is 265.05 g/mol.
Where can I buy 1-Acetyl-6-chloro-2-methyl-1h-indol-3-yl acetate?
You can request a quote for 1-Acetyl-6-chloro-2-methyl-1h-indol-3-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Acetyl-6-chloro-2-methyl-1h-indol-3-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 1-Acetyl-6-chloro-2-methyl-1h-indol-3-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.