1H-Indole-3-propanoic acid, 2-methyl-
TL;DR: 1H-Indole-3-propanoic acid, 2-methyl- (CAS 1136-87-4) is a chemical compound with molecular formula C12H13NO2 and molecular weight 203.09464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2-methyl-1H-indol-3-yl)propanoic acid
Also Known As: 3-(2-methyl-1H-indol-3-yl)propanoic acid, 1H-Indole-3-propanoic acid, 2-methyl-, 2-Methyl-1H-indole-3-propanoic acid, 1H-Indole-3-propanoic acid,2-methyl, 2-Methyl-1H-indole-3-propionic acid
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H13NO2 |
| Molecular Weight | 203.09464 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 53.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 203.09464 Da |
| Heavy Atoms | 15 |
| Complexity | 242.0 |
| SMILES | CC1=C(C2=CC=CC=C2N1)CCC(=O)O |
| InChIKey | MVCHNOBEGHXCDV-UHFFFAOYSA-N |
Chemical Property Profile of 1H-Indole-3-propanoic acid, 2-methyl-
Property Insights of 1H-Indole-3-propanoic acid, 2-methyl-
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Indole-3-propanoic acid, 2-methyl-. With a topological polar surface area (TPSA) of 53.1 Ų, 1H-Indole-3-propanoic acid, 2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Indole-3-propanoic acid, 2-methyl- 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
What is the CAS number of 1H-Indole-3-propanoic acid, 2-methyl-?
The CAS number of 1H-Indole-3-propanoic acid, 2-methyl- is 1136-87-4.
What is the molecular formula of 1H-Indole-3-propanoic acid, 2-methyl-?
The molecular formula of 1H-Indole-3-propanoic acid, 2-methyl- is C12H13NO2.
What is the molecular weight of 1H-Indole-3-propanoic acid, 2-methyl-?
The molecular weight of 1H-Indole-3-propanoic acid, 2-methyl- is 203.09464 g/mol.
Where can I buy 1H-Indole-3-propanoic acid, 2-methyl-?
You can request a quote for 1H-Indole-3-propanoic acid, 2-methyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1H-Indole-3-propanoic acid, 2-methyl-?
Yes, CoreyChem provides custom synthesis services for 1H-Indole-3-propanoic acid, 2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.