3-Indolylacetone
TL;DR: 3-Indolylacetone (CAS 1201-26-9) is a chemical compound with molecular formula C11H11NO and molecular weight 173.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1H-indol-3-yl)propan-2-one
Also Known As: 3-Indolylacetone, Indole-3-acetone, 1-(1H-indol-3-yl)propan-2-one, 3-(2-Oxopropyl)indole, 3-acetonylindole
| Molecular Formula | C11H11NO |
|---|---|
| Molecular Weight | 173.08 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 32.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 173.08406 |
| Heavy Atoms | 13 |
| Complexity | 202.0 |
Chemical Identifiers
| CAS Number | 1201-26-9 |
|---|---|
| SMILES | CC(=O)CC1=CNC2=CC=CC=C21 |
| InChIKey | LDVHYJKRIKBISQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Indolylacetone (CAS 1201-26-9), with molecular formula C11H11NO and molecular weight 173.08 g/mol. IUPAC: 1-(1H-indol-3-yl)propan-2-one.
Chemical Property Profile of 3-Indolylacetone
Property Insights of 3-Indolylacetone
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Indolylacetone. With a topological polar surface area (TPSA) of 32.9 Ų, 3-Indolylacetone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Indolylacetone has 1 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 3-Indolylacetone?
The CAS number of 3-Indolylacetone is 1201-26-9.
What is the molecular formula of 3-Indolylacetone?
The molecular formula of 3-Indolylacetone is C11H11NO.
What is the molecular weight of 3-Indolylacetone?
The molecular weight of 3-Indolylacetone is 173.08 g/mol.
Where can I buy 3-Indolylacetone?
You can request a quote for 3-Indolylacetone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Indolylacetone?
Yes, KEHONG BIO provides custom synthesis services for 3-Indolylacetone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.