4-methyl-2-oxo-2H-chromen-7-yl 2-chlorobenzoate
TL;DR: 4-methyl-2-oxo-2H-chromen-7-yl 2-chlorobenzoate (CAS 131425-63-3) is a chemical compound with molecular formula C17H11ClO4 and molecular weight 314.03458 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-methyl-2-oxochromen-7-yl) 2-chlorobenzoate
Also Known As: 4-methyl-2-oxo-2H-chromen-7-yl 2-chlorobenzoate, (4-methyl-2-oxochromen-7-yl) 2-chlorobenzoate, BAS 00558060, 4-methyl-2-oxochromen-7-yl 2-chlorobenzoate, AB00077981-01
Technical Specifications
| Molecular Formula | C17H11ClO4 |
| Molecular Weight | 314.03458 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 314.03458 Da |
| Heavy Atoms | 22 |
| Complexity | 487.0 |
| SMILES | CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C3=CC=CC=C3Cl |
| InChIKey | NKHRVJGWUVLTFP-UHFFFAOYSA-N |
Chemical Property Profile of 4-methyl-2-oxo-2H-chromen-7-yl 2-chlorobenzoate
Property Insights of 4-methyl-2-oxo-2H-chromen-7-yl 2-chlorobenzoate
The XLogP value of 4.3 indicates that 4-methyl-2-oxo-2H-chromen-7-yl 2-chlorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 4-methyl-2-oxo-2H-chromen-7-yl 2-chlorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-methyl-2-oxo-2H-chromen-7-yl 2-chlorobenzoate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-methyl-2-oxo-2H-chromen-7-yl 2-chlorobenzoate?
The CAS number of 4-methyl-2-oxo-2H-chromen-7-yl 2-chlorobenzoate is 131425-63-3.
What is the molecular formula of 4-methyl-2-oxo-2H-chromen-7-yl 2-chlorobenzoate?
The molecular formula of 4-methyl-2-oxo-2H-chromen-7-yl 2-chlorobenzoate is C17H11ClO4.
What is the molecular weight of 4-methyl-2-oxo-2H-chromen-7-yl 2-chlorobenzoate?
The molecular weight of 4-methyl-2-oxo-2H-chromen-7-yl 2-chlorobenzoate is 314.03458 g/mol.
Where can I buy 4-methyl-2-oxo-2H-chromen-7-yl 2-chlorobenzoate?
You can request a quote for 4-methyl-2-oxo-2H-chromen-7-yl 2-chlorobenzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-methyl-2-oxo-2H-chromen-7-yl 2-chlorobenzoate?
Yes, CoreyChem provides custom synthesis services for 4-methyl-2-oxo-2H-chromen-7-yl 2-chlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.