1H-Indol-2-yl propionate
TL;DR: 1H-Indol-2-yl propionate (CAS 84540-38-5) is a chemical compound with molecular formula C11H11NO2 and molecular weight 189.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1H-indol-2-yl propanoate
Also Known As: 1H-Indol-2-yl propionate, 1H-indol-2-yl propanoate, 1H-indol-2-ylpropionate, 1H-Indol-2-ol propanoate, 1H-Indol-2-ol,2-propanoate
| Molecular Formula | C11H11NO2 |
|---|---|
| Molecular Weight | 189.08 g/mol |
| LogP | 2.4833 |
| Topological Polar Surface Area | 42.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 189.07898 |
| Heavy Atoms | 14 |
| Complexity | 426.0104 |
Chemical Identifiers
| CAS Number | 84540-38-5 |
|---|---|
| SMILES | CCC(=O)OC1=CC2=CC=CC=C2N1 |
Product Overview
1H-Indol-2-yl propionate (CAS 84540-38-5), with molecular formula C11H11NO2 and molecular weight 189.08 g/mol. IUPAC: 1H-indol-2-yl propanoate.
Chemical Property Profile of 1H-Indol-2-yl propionate
Property Insights of 1H-Indol-2-yl propionate
The XLogP value of 2.4833 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Indol-2-yl propionate. With a topological polar surface area (TPSA) of 42.09 Ų, 1H-Indol-2-yl propionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Indol-2-yl propionate 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 1H-Indol-2-yl propionate?
The CAS number of 1H-Indol-2-yl propionate is 84540-38-5.
What is the molecular formula of 1H-Indol-2-yl propionate?
The molecular formula of 1H-Indol-2-yl propionate is C11H11NO2.
What is the molecular weight of 1H-Indol-2-yl propionate?
The molecular weight of 1H-Indol-2-yl propionate is 189.08 g/mol.
Where can I buy 1H-Indol-2-yl propionate?
You can request a quote for 1H-Indol-2-yl propionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Indol-2-yl propionate?
Yes, KEHONG BIO provides custom synthesis services for 1H-Indol-2-yl propionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.