Indoxyl acetate
TL;DR: Indoxyl acetate (CAS 608-08-2) is a chemical compound with molecular formula C10H9NO2 and molecular weight 175.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1H-indol-3-yl acetate
Also Known As: Indoxyl acetate, 3-Acetoxyindole, 1H-Indol-3-yl acetate, 3-Indolyl acetate, 3-Indoxyl acetate
| Molecular Formula | C10H9NO2 |
|---|---|
| Molecular Weight | 175.06 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 42.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 175.06332 |
| Heavy Atoms | 13 |
| Complexity | 205.0 |
| Vapor Pressure | 0.000209 [mmHg] |
Chemical Identifiers
| CAS Number | 608-08-2 |
|---|---|
| SMILES | CC(=O)OC1=CNC2=CC=CC=C21 |
| InChIKey | JBOPQACSHPPKEP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Indoxyl acetate (CAS 608-08-2), with molecular formula C10H9NO2 and molecular weight 175.06 g/mol. IUPAC: 1H-indol-3-yl acetate.
Chemical Property Profile of Indoxyl acetate
Property Insights of Indoxyl acetate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Indoxyl acetate. With a topological polar surface area (TPSA) of 42.1 Ų, Indoxyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Indoxyl acetate has 1 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 Indoxyl acetate?
The CAS number of Indoxyl acetate is 608-08-2.
What is the molecular formula of Indoxyl acetate?
The molecular formula of Indoxyl acetate is C10H9NO2.
What is the molecular weight of Indoxyl acetate?
The molecular weight of Indoxyl acetate is 175.06 g/mol.
Where can I buy Indoxyl acetate?
You can request a quote for Indoxyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Indoxyl acetate?
Yes, KEHONG BIO provides custom synthesis services for Indoxyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.