2-(5-hydroxy-1H-indol-3-yl)ethyl acetate
TL;DR: 2-(5-hydroxy-1H-indol-3-yl)ethyl acetate (CAS 91799-69-8) is a chemical compound with molecular formula C12H13NO3 and molecular weight 219.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-hydroxy-1H-indol-3-yl)ethyl acetate
Also Known As: O-Acetyl-5-hydroxytryptophol, A-5-HT, 2-(5-hydroxy-1h-indol-3-yl)ethyl acetate
| Molecular Formula | C12H13NO3 |
|---|---|
| Molecular Weight | 219.09 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 62.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 219.08954 |
| Heavy Atoms | 16 |
| Complexity | 257.0 |
Chemical Identifiers
| CAS Number | 91799-69-8 |
|---|---|
| SMILES | CC(=O)OCCC1=CNC2=C1C=C(C=C2)O |
| InChIKey | OREWHOOHFLYPLU-UHFFFAOYSA-N |
Product Overview
2-(5-hydroxy-1H-indol-3-yl)ethyl acetate (CAS 91799-69-8), with molecular formula C12H13NO3 and molecular weight 219.09 g/mol. IUPAC: 2-(5-hydroxy-1H-indol-3-yl)ethyl acetate.
Chemical Property Profile of 2-(5-hydroxy-1H-indol-3-yl)ethyl acetate
Property Insights of 2-(5-hydroxy-1H-indol-3-yl)ethyl acetate
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(5-hydroxy-1H-indol-3-yl)ethyl acetate. The TPSA of 62.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(5-hydroxy-1H-indol-3-yl)ethyl acetate. Following Lipinski's Rule of Five, 2-(5-hydroxy-1H-indol-3-yl)ethyl acetate has 2 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 2-(5-hydroxy-1H-indol-3-yl)ethyl acetate?
The CAS number of 2-(5-hydroxy-1H-indol-3-yl)ethyl acetate is 91799-69-8.
What is the molecular formula of 2-(5-hydroxy-1H-indol-3-yl)ethyl acetate?
The molecular formula of 2-(5-hydroxy-1H-indol-3-yl)ethyl acetate is C12H13NO3.
What is the molecular weight of 2-(5-hydroxy-1H-indol-3-yl)ethyl acetate?
The molecular weight of 2-(5-hydroxy-1H-indol-3-yl)ethyl acetate is 219.09 g/mol.
Where can I buy 2-(5-hydroxy-1H-indol-3-yl)ethyl acetate?
You can request a quote for 2-(5-hydroxy-1H-indol-3-yl)ethyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(5-hydroxy-1H-indol-3-yl)ethyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-(5-hydroxy-1H-indol-3-yl)ethyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.