4-(4-Bromophenyl)-2-butanone
TL;DR: 4-(4-Bromophenyl)-2-butanone (CAS 89201-84-3) is a chemical compound with molecular formula C10H11BrO and molecular weight 226.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-bromophenyl)butan-2-one
Also Known As: 4-(4-bromophenyl)butan-2-one, 4-(4-BROMOPHENYL)-2-BUTANONE, 4-Hydroxyvalerophenone, 2-Butanone, 4-(4-bromophenyl)-, 1-Methyl-3-(4-bromophenyl)propane-1-al
| Molecular Formula | C10H11BrO |
|---|---|
| Molecular Weight | 226.00 g/mol |
| LogP | 2.9707 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 225.99933 |
| Heavy Atoms | 12 |
| Complexity | 263.672 |
Chemical Identifiers
| CAS Number | 89201-84-3 |
|---|---|
| SMILES | CC(=O)CCC1=CC=C(C=C1)Br |
Product Overview
4-(4-Bromophenyl)-2-butanone (CAS 89201-84-3), with molecular formula C10H11BrO and molecular weight 226.00 g/mol. IUPAC: 4-(4-bromophenyl)butan-2-one.
Chemical Property Profile of 4-(4-Bromophenyl)-2-butanone
Property Insights of 4-(4-Bromophenyl)-2-butanone
The XLogP value of 2.9707 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Bromophenyl)-2-butanone. With a topological polar surface area (TPSA) of 17.07 Ų, 4-(4-Bromophenyl)-2-butanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Bromophenyl)-2-butanone 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
Frequently Asked Questions
What is the CAS number of 4-(4-Bromophenyl)-2-butanone?
The CAS number of 4-(4-Bromophenyl)-2-butanone is 89201-84-3.
What is the molecular formula of 4-(4-Bromophenyl)-2-butanone?
The molecular formula of 4-(4-Bromophenyl)-2-butanone is C10H11BrO.
What is the molecular weight of 4-(4-Bromophenyl)-2-butanone?
The molecular weight of 4-(4-Bromophenyl)-2-butanone is 226.00 g/mol.
Where can I buy 4-(4-Bromophenyl)-2-butanone?
You can request a quote for 4-(4-Bromophenyl)-2-butanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Bromophenyl)-2-butanone?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Bromophenyl)-2-butanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.