methyl 1H-indole-5-carboxylate
TL;DR: methyl 1H-indole-5-carboxylate (CAS 1011-65-0) 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.
methyl 1H-indole-5-carboxylate
Also Known As: Methyl indole-5-carboxylate, methyl 1H-indole-5-carboxylate, Indole-5-carboxylate, 5-methoxycarbonylindole, Indole-5-carboxylic Acid Methyl Ester
| Molecular Formula | C10H9NO2 |
|---|---|
| Molecular Weight | 175.06 g/mol |
| LogP | 1.9545 |
| Topological Polar Surface Area | 42.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 175.06332 |
| Heavy Atoms | 13 |
| Complexity | 444.8764 |
Chemical Identifiers
| CAS Number | 1011-65-0 |
|---|---|
| SMILES | COC(=O)C1=CC2=C(C=C1)NC=C2 |
Product Overview
methyl 1H-indole-5-carboxylate (CAS 1011-65-0), with molecular formula C10H9NO2 and molecular weight 175.06 g/mol. IUPAC: methyl 1H-indole-5-carboxylate.
Chemical Property Profile of methyl 1H-indole-5-carboxylate
Property Insights of methyl 1H-indole-5-carboxylate
The XLogP value of 1.9545 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 1H-indole-5-carboxylate. With a topological polar surface area (TPSA) of 42.09 Ų, methyl 1H-indole-5-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 1H-indole-5-carboxylate 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 methyl 1H-indole-5-carboxylate?
The CAS number of methyl 1H-indole-5-carboxylate is 1011-65-0.
What is the molecular formula of methyl 1H-indole-5-carboxylate?
The molecular formula of methyl 1H-indole-5-carboxylate is C10H9NO2.
What is the molecular weight of methyl 1H-indole-5-carboxylate?
The molecular weight of methyl 1H-indole-5-carboxylate is 175.06 g/mol.
Where can I buy methyl 1H-indole-5-carboxylate?
You can request a quote for methyl 1H-indole-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 1H-indole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 1H-indole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.