2-(Bromoethanoyloxy)-2-phenylethanoic acid
TL;DR: 2-(Bromoethanoyloxy)-2-phenylethanoic acid (CAS 138914-16-6) is a chemical compound with molecular formula C10H9BrO4 and molecular weight 271.9684 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-bromoacetyl)oxy-2-phenylacetic acid
Also Known As: 2-Bepe, 2-(Bromoethanoyloxy)-2-phenylethanoic acid, 2-(2-bromoacetyl)oxy-2-phenylacetic acid, [(Bromoacetyl)oxy](phenyl)acetic acid, Benzeneacetic acid, a-[(bromoacetyl)oxy]-, (R)- (9CI)
Technical Specifications
| Molecular Formula | C10H9BrO4 |
| Molecular Weight | 271.9684 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 271.9684 Da |
| Heavy Atoms | 15 |
| Complexity | 236.0 |
| SMILES | C1=CC=C(C=C1)C(C(=O)O)OC(=O)CBr |
| InChIKey | WCHOMUSGCZCIFC-UHFFFAOYSA-N |
Chemical Property Profile of 2-(Bromoethanoyloxy)-2-phenylethanoic acid
Property Insights of 2-(Bromoethanoyloxy)-2-phenylethanoic acid
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Bromoethanoyloxy)-2-phenylethanoic acid. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Bromoethanoyloxy)-2-phenylethanoic acid. Following Lipinski's Rule of Five, 2-(Bromoethanoyloxy)-2-phenylethanoic acid has 1 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 2-(Bromoethanoyloxy)-2-phenylethanoic acid?
The CAS number of 2-(Bromoethanoyloxy)-2-phenylethanoic acid is 138914-16-6.
What is the molecular formula of 2-(Bromoethanoyloxy)-2-phenylethanoic acid?
The molecular formula of 2-(Bromoethanoyloxy)-2-phenylethanoic acid is C10H9BrO4.
What is the molecular weight of 2-(Bromoethanoyloxy)-2-phenylethanoic acid?
The molecular weight of 2-(Bromoethanoyloxy)-2-phenylethanoic acid is 271.9684 g/mol.
Where can I buy 2-(Bromoethanoyloxy)-2-phenylethanoic acid?
You can request a quote for 2-(Bromoethanoyloxy)-2-phenylethanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(Bromoethanoyloxy)-2-phenylethanoic acid?
Yes, CoreyChem provides custom synthesis services for 2-(Bromoethanoyloxy)-2-phenylethanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.