Methyl 3-(3-methyl-1-benzofuran-2-yl)prop-2-enoate
TL;DR: Methyl 3-(3-methyl-1-benzofuran-2-yl)prop-2-enoate (CAS 1253180-92-5) is a chemical compound with molecular formula C13H12O3 and molecular weight 216.07864 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 3-(3-methyl-1-benzofuran-2-yl)prop-2-enoate
Also Known As: methyl 3-(3-methyl-1-benzofuran-2-yl)prop-2-enoate, methyl 3-(3-methyl-1-benzofuran-2-yl)acrylate
Technical Specifications
| Molecular Formula | C13H12O3 |
| Molecular Weight | 216.07864 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 39.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 216.07864 Da |
| Heavy Atoms | 16 |
| Complexity | 285.0 |
| SMILES | CC1=C(OC2=CC=CC=C12)C=CC(=O)OC |
| InChIKey | SDMBVFSLDAVEQI-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 3-(3-methyl-1-benzofuran-2-yl)prop-2-enoate
Property Insights of Methyl 3-(3-methyl-1-benzofuran-2-yl)prop-2-enoate
The XLogP value of 3.0 indicates that Methyl 3-(3-methyl-1-benzofuran-2-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 39.4 Ų, Methyl 3-(3-methyl-1-benzofuran-2-yl)prop-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-(3-methyl-1-benzofuran-2-yl)prop-2-enoate has 0 hydrogen bond donor(s) and 3 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-(3-methyl-1-benzofuran-2-yl)prop-2-enoate?
The CAS number of Methyl 3-(3-methyl-1-benzofuran-2-yl)prop-2-enoate is 1253180-92-5.
What is the molecular formula of Methyl 3-(3-methyl-1-benzofuran-2-yl)prop-2-enoate?
The molecular formula of Methyl 3-(3-methyl-1-benzofuran-2-yl)prop-2-enoate is C13H12O3.
What is the molecular weight of Methyl 3-(3-methyl-1-benzofuran-2-yl)prop-2-enoate?
The molecular weight of Methyl 3-(3-methyl-1-benzofuran-2-yl)prop-2-enoate is 216.07864 g/mol.
Where can I buy Methyl 3-(3-methyl-1-benzofuran-2-yl)prop-2-enoate?
You can request a quote for Methyl 3-(3-methyl-1-benzofuran-2-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-(3-methyl-1-benzofuran-2-yl)prop-2-enoate?
Yes, CoreyChem provides custom synthesis services for Methyl 3-(3-methyl-1-benzofuran-2-yl)prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.