3-Bromo-4-methoxybenzoyl chloride
TL;DR: 3-Bromo-4-methoxybenzoyl chloride (CAS 81324-61-0) is a chemical compound with molecular formula C8H6BrClO2 and molecular weight 247.92397 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-bromo-4-methoxybenzoyl chloride
Also Known As: 3-bromo-4-methoxybenzoyl chloride, null, 3-bromo-4-methoxy-benzoyl Chloride, 3-Bromo-4-methoxybenzoylchloride, H61891
Technical Specifications
| Molecular Formula | C8H6BrClO2 |
| Molecular Weight | 247.92397 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 247.92397 Da |
| Heavy Atoms | 12 |
| Complexity | 174.0 |
| SMILES | COC1=C(C=C(C=C1)C(=O)Cl)Br |
| InChIKey | UAAQIUYOLQEKLN-UHFFFAOYSA-N |
Chemical Property Profile of 3-Bromo-4-methoxybenzoyl chloride
Property Insights of 3-Bromo-4-methoxybenzoyl chloride
The XLogP value of 3.3 indicates that 3-Bromo-4-methoxybenzoyl 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-Bromo-4-methoxybenzoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Bromo-4-methoxybenzoyl 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-Bromo-4-methoxybenzoyl chloride?
The CAS number of 3-Bromo-4-methoxybenzoyl chloride is 81324-61-0.
What is the molecular formula of 3-Bromo-4-methoxybenzoyl chloride?
The molecular formula of 3-Bromo-4-methoxybenzoyl chloride is C8H6BrClO2.
What is the molecular weight of 3-Bromo-4-methoxybenzoyl chloride?
The molecular weight of 3-Bromo-4-methoxybenzoyl chloride is 247.92397 g/mol.
Where can I buy 3-Bromo-4-methoxybenzoyl chloride?
You can request a quote for 3-Bromo-4-methoxybenzoyl chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Bromo-4-methoxybenzoyl chloride?
Yes, CoreyChem provides custom synthesis services for 3-Bromo-4-methoxybenzoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.