Methyl 3-benzoyloxybenzoate
TL;DR: Methyl 3-benzoyloxybenzoate (CAS 108011-99-0) is a chemical compound with molecular formula C15H12O4 and molecular weight 256.07355 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 3-benzoyloxybenzoate
Also Known As: methyl 3-benzoyloxybenzoate, methyl 3-(benzoyloxy)benzoate, 3-(methoxycarbonyl)phenyl benzoate, 3-benzoyloxy-benzoic acid methyl ester, methyl 3-[(phenylcarbonyl)oxy]benzoate
Technical Specifications
| Molecular Formula | C15H12O4 |
| Molecular Weight | 256.07355 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 256.07355 Da |
| Heavy Atoms | 19 |
| Complexity | 320.0 |
| SMILES | COC(=O)C1=CC(=CC=C1)OC(=O)C2=CC=CC=C2 |
| InChIKey | KVRXWEPDKFBLAF-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 3-benzoyloxybenzoate
Property Insights of Methyl 3-benzoyloxybenzoate
The XLogP value of 3.2 indicates that Methyl 3-benzoyloxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Methyl 3-benzoyloxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-benzoyloxybenzoate 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 Methyl 3-benzoyloxybenzoate?
The CAS number of Methyl 3-benzoyloxybenzoate is 108011-99-0.
What is the molecular formula of Methyl 3-benzoyloxybenzoate?
The molecular formula of Methyl 3-benzoyloxybenzoate is C15H12O4.
What is the molecular weight of Methyl 3-benzoyloxybenzoate?
The molecular weight of Methyl 3-benzoyloxybenzoate is 256.07355 g/mol.
Where can I buy Methyl 3-benzoyloxybenzoate?
You can request a quote for Methyl 3-benzoyloxybenzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 3-benzoyloxybenzoate?
Yes, CoreyChem provides custom synthesis services for Methyl 3-benzoyloxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.