3-Phenoxybenzoyl chloride
TL;DR: 3-Phenoxybenzoyl chloride (CAS 107622-80-0) is a chemical compound with molecular formula C13H9ClO2 and molecular weight 232.02911 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-phenoxybenzoyl chloride
Also Known As: 3-phenoxybenzoyl chloride, 4-Phenoxybenzylamine, 3-phenoxybenzoylchloride, Benzoyl chloride, 3-phenoxy-, m-Phenoxybenzoyl chloride
Technical Specifications
| Molecular Formula | C13H9ClO2 |
| Molecular Weight | 232.02911 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 232.02911 Da |
| Heavy Atoms | 16 |
| Complexity | 236.0 |
| SMILES | C1=CC=C(C=C1)OC2=CC=CC(=C2)C(=O)Cl |
| InChIKey | TTZXIWBOKOZOPL-UHFFFAOYSA-N |
Chemical Property Profile of 3-Phenoxybenzoyl chloride
Property Insights of 3-Phenoxybenzoyl chloride
The XLogP value of 4.9 indicates that 3-Phenoxybenzoyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 3-Phenoxybenzoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenoxybenzoyl chloride has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Phenoxybenzoyl chloride?
The CAS number of 3-Phenoxybenzoyl chloride is 107622-80-0.
What is the molecular formula of 3-Phenoxybenzoyl chloride?
The molecular formula of 3-Phenoxybenzoyl chloride is C13H9ClO2.
What is the molecular weight of 3-Phenoxybenzoyl chloride?
The molecular weight of 3-Phenoxybenzoyl chloride is 232.02911 g/mol.
Where can I buy 3-Phenoxybenzoyl chloride?
You can request a quote for 3-Phenoxybenzoyl chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Phenoxybenzoyl chloride?
Yes, CoreyChem provides custom synthesis services for 3-Phenoxybenzoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.