(2S)-2-(1H-indol-3-yl)propanoic acid
TL;DR: (2S)-2-(1H-indol-3-yl)propanoic acid (CAS 21070-37-1) 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.
(2S)-2-(1H-indol-3-yl)propanoic acid
Also Known As: (+)-alpha-Methylheteroauxin, 2-(1H-indol-3-yl)propanoic acid, (2S)-2-(1H-indol-3-yl)propanoic acid, (S)-2-(1H-indol-3-yl)propanoic acid, [S,(+)]-alpha-Methyl-1H-indole-3-acetic acid
| Molecular Formula | C11H11NO2 |
|---|---|
| Molecular Weight | 189.08 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 53.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 189.07898 |
| Heavy Atoms | 14 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 21070-37-1 |
|---|---|
| SMILES | C[C@@H](C1=CNC2=CC=CC=C21)C(=O)O |
| InChIKey | WNVIEMRKZPPPOJ-ZETCQYMHSA-N |
Product Overview
(2S)-2-(1H-indol-3-yl)propanoic acid (CAS 21070-37-1), with molecular formula C11H11NO2 and molecular weight 189.08 g/mol. IUPAC: (2S)-2-(1H-indol-3-yl)propanoic acid.
Chemical Property Profile of (2S)-2-(1H-indol-3-yl)propanoic acid
Property Insights of (2S)-2-(1H-indol-3-yl)propanoic acid
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-2-(1H-indol-3-yl)propanoic acid. With a topological polar surface area (TPSA) of 53.1 Ų, (2S)-2-(1H-indol-3-yl)propanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2S)-2-(1H-indol-3-yl)propanoic acid has 2 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 (2S)-2-(1H-indol-3-yl)propanoic acid?
The CAS number of (2S)-2-(1H-indol-3-yl)propanoic acid is 21070-37-1.
What is the molecular formula of (2S)-2-(1H-indol-3-yl)propanoic acid?
The molecular formula of (2S)-2-(1H-indol-3-yl)propanoic acid is C11H11NO2.
What is the molecular weight of (2S)-2-(1H-indol-3-yl)propanoic acid?
The molecular weight of (2S)-2-(1H-indol-3-yl)propanoic acid is 189.08 g/mol.
Where can I buy (2S)-2-(1H-indol-3-yl)propanoic acid?
You can request a quote for (2S)-2-(1H-indol-3-yl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-2-(1H-indol-3-yl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-(1H-indol-3-yl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.