2-Propenoic acid, 3-(1-methyl-1H-indol-2-yl)-, methyl ester
TL;DR: 2-Propenoic acid, 3-(1-methyl-1H-indol-2-yl)-, methyl ester (CAS 66314-19-0) is a chemical compound with molecular formula C13H13NO2 and molecular weight 215.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(1-methylindol-2-yl)prop-2-enoate
Also Known As: Methyl 3-(1-methylindol-2-yl)prop-2-enoate, 2-Propenoic acid, 3-(1-methyl-1H-indol-2-yl)-, methyl ester, Methyl 3-(1-methyl-1H-indol-2-yl)prop-2-enoate, 2-Propenoic acid,3-(1-methyl-1H-indol-2-yl)-,methyl ester
| Molecular Formula | C13H13NO2 |
|---|---|
| Molecular Weight | 215.09 g/mol |
| LogP | 2.3645 |
| Topological Polar Surface Area | 31.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 215.09464 |
| Heavy Atoms | 16 |
| Complexity | 552.058 |
Chemical Identifiers
| CAS Number | 66314-19-0 |
|---|---|
| SMILES | CN1C2=CC=CC=C2C=C1C=CC(=O)OC |
Product Overview
2-Propenoic acid, 3-(1-methyl-1H-indol-2-yl)-, methyl ester (CAS 66314-19-0), with molecular formula C13H13NO2 and molecular weight 215.09 g/mol. IUPAC: methyl 3-(1-methylindol-2-yl)prop-2-enoate.
Chemical Property Profile of 2-Propenoic acid, 3-(1-methyl-1H-indol-2-yl)-, methyl ester
Property Insights of 2-Propenoic acid, 3-(1-methyl-1H-indol-2-yl)-, methyl ester
The XLogP value of 2.3645 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propenoic acid, 3-(1-methyl-1H-indol-2-yl)-, methyl ester. With a topological polar surface area (TPSA) of 31.23 Ų, 2-Propenoic acid, 3-(1-methyl-1H-indol-2-yl)-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propenoic acid, 3-(1-methyl-1H-indol-2-yl)-, methyl ester has 0 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 2-Propenoic acid, 3-(1-methyl-1H-indol-2-yl)-, methyl ester?
The CAS number of 2-Propenoic acid, 3-(1-methyl-1H-indol-2-yl)-, methyl ester is 66314-19-0.
What is the molecular formula of 2-Propenoic acid, 3-(1-methyl-1H-indol-2-yl)-, methyl ester?
The molecular formula of 2-Propenoic acid, 3-(1-methyl-1H-indol-2-yl)-, methyl ester is C13H13NO2.
What is the molecular weight of 2-Propenoic acid, 3-(1-methyl-1H-indol-2-yl)-, methyl ester?
The molecular weight of 2-Propenoic acid, 3-(1-methyl-1H-indol-2-yl)-, methyl ester is 215.09 g/mol.
Where can I buy 2-Propenoic acid, 3-(1-methyl-1H-indol-2-yl)-, methyl ester?
You can request a quote for 2-Propenoic acid, 3-(1-methyl-1H-indol-2-yl)-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propenoic acid, 3-(1-methyl-1H-indol-2-yl)-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Propenoic acid, 3-(1-methyl-1H-indol-2-yl)-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.