(Acetyloxy)(2-bromophenyl)methyl acetate
TL;DR: (Acetyloxy)(2-bromophenyl)methyl acetate (CAS 60229-71-2) is a chemical compound with molecular formula C11H11BrO4 and molecular weight 285.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[acetyloxy-(2-bromophenyl)methyl] acetate
Also Known As: 2-Bromobenzylidenediacetate, (2-bromophenyl)methylenediacetate, (acetyloxy)(2-bromophenyl)methyl acetate, [acetyloxy-(2-bromophenyl)methyl] Acetate, J2.301.697D
| Molecular Formula | C11H11BrO4 |
|---|---|
| Molecular Weight | 285.98 g/mol |
| LogP | 2.5739 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 285.98407 |
| Heavy Atoms | 16 |
| Complexity | 386.72595 |
Chemical Identifiers
| CAS Number | 60229-71-2 |
|---|---|
| SMILES | CC(=O)OC(C1=CC=CC=C1Br)OC(=O)C |
Product Overview
(Acetyloxy)(2-bromophenyl)methyl acetate (CAS 60229-71-2), with molecular formula C11H11BrO4 and molecular weight 285.98 g/mol. IUPAC: [acetyloxy-(2-bromophenyl)methyl] acetate.
Chemical Property Profile of (Acetyloxy)(2-bromophenyl)methyl acetate
Property Insights of (Acetyloxy)(2-bromophenyl)methyl acetate
The XLogP value of 2.5739 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Acetyloxy)(2-bromophenyl)methyl acetate. With a topological polar surface area (TPSA) of 52.6 Ų, (Acetyloxy)(2-bromophenyl)methyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Acetyloxy)(2-bromophenyl)methyl acetate has 0 hydrogen bond donor(s) and 4 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 (Acetyloxy)(2-bromophenyl)methyl acetate?
The CAS number of (Acetyloxy)(2-bromophenyl)methyl acetate is 60229-71-2.
What is the molecular formula of (Acetyloxy)(2-bromophenyl)methyl acetate?
The molecular formula of (Acetyloxy)(2-bromophenyl)methyl acetate is C11H11BrO4.
What is the molecular weight of (Acetyloxy)(2-bromophenyl)methyl acetate?
The molecular weight of (Acetyloxy)(2-bromophenyl)methyl acetate is 285.98 g/mol.
Where can I buy (Acetyloxy)(2-bromophenyl)methyl acetate?
You can request a quote for (Acetyloxy)(2-bromophenyl)methyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Acetyloxy)(2-bromophenyl)methyl acetate?
Yes, KEHONG BIO provides custom synthesis services for (Acetyloxy)(2-bromophenyl)methyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.