![1-[4-(Acetyloxy)phenyl]-3-bromo-2-propanone structure](/static/products/5607/56071-69-3.webp)
1-[4-(Acetyloxy)phenyl]-3-bromo-2-propanone
TL;DR: 1-[4-(Acetyloxy)phenyl]-3-bromo-2-propanone (CAS 56071-69-3) is a chemical compound with molecular formula C11H11BrO3 and molecular weight 269.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(3-bromo-2-oxopropyl)phenyl] acetate
Also Known As: 1-[4-(ACETYLOXY)PHENYL]-3-BROMO-2-PROPANONE, [4-(3-bromo-2-oxopropyl)phenyl] acetate, 4-(3-Bromo-2-oxopropyl)phenyl acetate, [4-(3-bromo-2-oxo-propyl)phenyl] Acetate, 2-Propanone,1-[4-(acetyloxy)phenyl]-3-bromo-
| Molecular Formula | C11H11BrO3 |
|---|---|
| Molecular Weight | 269.99 g/mol |
| LogP | 2.1184 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 269.98917 |
| Heavy Atoms | 15 |
| Complexity | 356.6007 |
Chemical Identifiers
| CAS Number | 56071-69-3 |
|---|---|
| SMILES | CC(=O)OC1=CC=C(C=C1)CC(=O)CBr |
Product Overview
1-[4-(Acetyloxy)phenyl]-3-bromo-2-propanone (CAS 56071-69-3), with molecular formula C11H11BrO3 and molecular weight 269.99 g/mol. IUPAC: [4-(3-bromo-2-oxopropyl)phenyl] acetate.
Chemical Property Profile of 1-[4-(Acetyloxy)phenyl]-3-bromo-2-propanone
Property Insights of 1-[4-(Acetyloxy)phenyl]-3-bromo-2-propanone
The XLogP value of 2.1184 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[4-(Acetyloxy)phenyl]-3-bromo-2-propanone. With a topological polar surface area (TPSA) of 43.37 Ų, 1-[4-(Acetyloxy)phenyl]-3-bromo-2-propanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[4-(Acetyloxy)phenyl]-3-bromo-2-propanone has 0 hydrogen bond donor(s) and 3 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 1-[4-(Acetyloxy)phenyl]-3-bromo-2-propanone?
The CAS number of 1-[4-(Acetyloxy)phenyl]-3-bromo-2-propanone is 56071-69-3.
What is the molecular formula of 1-[4-(Acetyloxy)phenyl]-3-bromo-2-propanone?
The molecular formula of 1-[4-(Acetyloxy)phenyl]-3-bromo-2-propanone is C11H11BrO3.
What is the molecular weight of 1-[4-(Acetyloxy)phenyl]-3-bromo-2-propanone?
The molecular weight of 1-[4-(Acetyloxy)phenyl]-3-bromo-2-propanone is 269.99 g/mol.
Where can I buy 1-[4-(Acetyloxy)phenyl]-3-bromo-2-propanone?
You can request a quote for 1-[4-(Acetyloxy)phenyl]-3-bromo-2-propanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[4-(Acetyloxy)phenyl]-3-bromo-2-propanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-(Acetyloxy)phenyl]-3-bromo-2-propanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.