2-((Benzoyloxy)methyl)benzoyl chloride
TL;DR: 2-((Benzoyloxy)methyl)benzoyl chloride (CAS 58249-87-9) is a chemical compound with molecular formula C15H11ClO3 and molecular weight 274.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-carbonochloridoylphenyl)methyl benzoate
Also Known As: 2-(Benzoyloxymethyl)benzoyl chloride, 3-ethoxy-pyrocatechol, (2-carbonochloridoylphenyl)methyl benzoate, 2-(chlorocarbonyl)benzyl benzoate, 2-((Benzoyloxy)methyl)benzoyl chloride
| Molecular Formula | C15H11ClO3 |
|---|---|
| Molecular Weight | 274.04 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 274.03967 |
| Heavy Atoms | 19 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 58249-87-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)OCC2=CC=CC=C2C(=O)Cl |
| InChIKey | UDEQFYWNFHWPRH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-((Benzoyloxy)methyl)benzoyl chloride (CAS 58249-87-9), with molecular formula C15H11ClO3 and molecular weight 274.04 g/mol. IUPAC: (2-carbonochloridoylphenyl)methyl benzoate.
Chemical Property Profile of 2-((Benzoyloxy)methyl)benzoyl chloride
Property Insights of 2-((Benzoyloxy)methyl)benzoyl chloride
The XLogP value of 3.8 indicates that 2-((Benzoyloxy)methyl)benzoyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, 2-((Benzoyloxy)methyl)benzoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((Benzoyloxy)methyl)benzoyl chloride 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
Frequently Asked Questions
What is the CAS number of 2-((Benzoyloxy)methyl)benzoyl chloride?
The CAS number of 2-((Benzoyloxy)methyl)benzoyl chloride is 58249-87-9.
What is the molecular formula of 2-((Benzoyloxy)methyl)benzoyl chloride?
The molecular formula of 2-((Benzoyloxy)methyl)benzoyl chloride is C15H11ClO3.
What is the molecular weight of 2-((Benzoyloxy)methyl)benzoyl chloride?
The molecular weight of 2-((Benzoyloxy)methyl)benzoyl chloride is 274.04 g/mol.
Where can I buy 2-((Benzoyloxy)methyl)benzoyl chloride?
You can request a quote for 2-((Benzoyloxy)methyl)benzoyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((Benzoyloxy)methyl)benzoyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 2-((Benzoyloxy)methyl)benzoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.