methyl 3-(6-bromo-1H-indol-3-yl)prop-2-enoate
TL;DR: methyl 3-(6-bromo-1H-indol-3-yl)prop-2-enoate (CAS 134419-23-1) is a chemical compound with molecular formula C12H10BrNO2 and molecular weight 278.9895 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 3-(6-bromo-1H-indol-3-yl)prop-2-enoate
Also Known As: Methyl (E)-3-(6-bromo-1H-indol-3-yl)prop-2-enoate, 2-Propenoic acid, 3-(6-bromo-1H-indol-3-yl)-, methyl ester, (E)-
Technical Specifications
| Molecular Formula | C12H10BrNO2 |
| Molecular Weight | 278.9895 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 42.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.9895 Da |
| Heavy Atoms | 16 |
| Complexity | 293.0 |
| SMILES | COC(=O)C=CC1=CNC2=C1C=CC(=C2)Br |
| InChIKey | KXOFEQMCIBBYME-UHFFFAOYSA-N |
Chemical Property Profile of methyl 3-(6-bromo-1H-indol-3-yl)prop-2-enoate
Property Insights of methyl 3-(6-bromo-1H-indol-3-yl)prop-2-enoate
The XLogP value of 3.0 indicates that methyl 3-(6-bromo-1H-indol-3-yl)prop-2-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.1 Ų, methyl 3-(6-bromo-1H-indol-3-yl)prop-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 3-(6-bromo-1H-indol-3-yl)prop-2-enoate 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
What is the CAS number of methyl 3-(6-bromo-1H-indol-3-yl)prop-2-enoate?
The CAS number of methyl 3-(6-bromo-1H-indol-3-yl)prop-2-enoate is 134419-23-1.
What is the molecular formula of methyl 3-(6-bromo-1H-indol-3-yl)prop-2-enoate?
The molecular formula of methyl 3-(6-bromo-1H-indol-3-yl)prop-2-enoate is C12H10BrNO2.
What is the molecular weight of methyl 3-(6-bromo-1H-indol-3-yl)prop-2-enoate?
The molecular weight of methyl 3-(6-bromo-1H-indol-3-yl)prop-2-enoate is 278.9895 g/mol.
Where can I buy methyl 3-(6-bromo-1H-indol-3-yl)prop-2-enoate?
You can request a quote for methyl 3-(6-bromo-1H-indol-3-yl)prop-2-enoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for methyl 3-(6-bromo-1H-indol-3-yl)prop-2-enoate?
Yes, CoreyChem provides custom synthesis services for methyl 3-(6-bromo-1H-indol-3-yl)prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.