Methyl 3-(5-chloro-1-benzofuran-2-yl)prop-2-enoate
TL;DR: Methyl 3-(5-chloro-1-benzofuran-2-yl)prop-2-enoate (CAS 1421617-68-6) is a chemical compound with molecular formula C12H9ClO3 and molecular weight 236.02402 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 3-(5-chloro-1-benzofuran-2-yl)prop-2-enoate
Also Known As: methyl 3-(5-chloro-1-benzofuran-2-yl)prop-2-enoate, 3-(5-CHLORO-BENZOFURAN-2-YL)-ACRYLIC ACID METHYL ESTER, methyl (E)-3-(5-chloro-1-benzofuran-2-yl)-2-propenoate
Technical Specifications
| Molecular Formula | C12H9ClO3 |
| Molecular Weight | 236.02402 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 39.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.02402 Da |
| Heavy Atoms | 16 |
| Complexity | 290.0 |
| SMILES | COC(=O)C=CC1=CC2=C(O1)C=CC(=C2)Cl |
| InChIKey | GBRJKCZJDBIVIX-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 3-(5-chloro-1-benzofuran-2-yl)prop-2-enoate
Property Insights of Methyl 3-(5-chloro-1-benzofuran-2-yl)prop-2-enoate
The XLogP value of 3.3 indicates that Methyl 3-(5-chloro-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-(5-chloro-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-(5-chloro-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-(5-chloro-1-benzofuran-2-yl)prop-2-enoate?
The CAS number of Methyl 3-(5-chloro-1-benzofuran-2-yl)prop-2-enoate is 1421617-68-6.
What is the molecular formula of Methyl 3-(5-chloro-1-benzofuran-2-yl)prop-2-enoate?
The molecular formula of Methyl 3-(5-chloro-1-benzofuran-2-yl)prop-2-enoate is C12H9ClO3.
What is the molecular weight of Methyl 3-(5-chloro-1-benzofuran-2-yl)prop-2-enoate?
The molecular weight of Methyl 3-(5-chloro-1-benzofuran-2-yl)prop-2-enoate is 236.02402 g/mol.
Where can I buy Methyl 3-(5-chloro-1-benzofuran-2-yl)prop-2-enoate?
You can request a quote for Methyl 3-(5-chloro-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-(5-chloro-1-benzofuran-2-yl)prop-2-enoate?
Yes, CoreyChem provides custom synthesis services for Methyl 3-(5-chloro-1-benzofuran-2-yl)prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.