4-(1,2-dibromoethyl)benzoyl Chloride
TL;DR: 4-(1,2-dibromoethyl)benzoyl Chloride (CAS 108614-49-9) is a chemical compound with molecular formula C9H7Br2ClO and molecular weight 323.85522 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(1,2-dibromoethyl)benzoyl chloride
Also Known As: 4-(1,2-dibromoethyl)benzoyl Chloride, Benzoyl chloride, 4-(1,2-dibromoethyl)-
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H7Br2ClO |
| Molecular Weight | 323.85522 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 323.85522 Da |
| Heavy Atoms | 13 |
| Complexity | 178.0 |
| SMILES | C1=CC(=CC=C1C(CBr)Br)C(=O)Cl |
| InChIKey | SVEDLBODLMOYRB-UHFFFAOYSA-N |
Chemical Property Profile of 4-(1,2-dibromoethyl)benzoyl Chloride
Property Insights of 4-(1,2-dibromoethyl)benzoyl Chloride
The XLogP value of 3.8 indicates that 4-(1,2-dibromoethyl)benzoyl Chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 4-(1,2-dibromoethyl)benzoyl Chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(1,2-dibromoethyl)benzoyl Chloride has 0 hydrogen bond donor(s) and 1 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-(1,2-dibromoethyl)benzoyl Chloride?
The CAS number of 4-(1,2-dibromoethyl)benzoyl Chloride is 108614-49-9.
What is the molecular formula of 4-(1,2-dibromoethyl)benzoyl Chloride?
The molecular formula of 4-(1,2-dibromoethyl)benzoyl Chloride is C9H7Br2ClO.
What is the molecular weight of 4-(1,2-dibromoethyl)benzoyl Chloride?
The molecular weight of 4-(1,2-dibromoethyl)benzoyl Chloride is 323.85522 g/mol.
Where can I buy 4-(1,2-dibromoethyl)benzoyl Chloride?
You can request a quote for 4-(1,2-dibromoethyl)benzoyl Chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(1,2-dibromoethyl)benzoyl Chloride?
Yes, CoreyChem provides custom synthesis services for 4-(1,2-dibromoethyl)benzoyl Chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.