4-Bromochalcone
TL;DR: 4-Bromochalcone (CAS 18137-96-7) is a chemical compound with molecular formula C15H11BrO and molecular weight 286.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(4-bromophenyl)-1-phenylprop-2-en-1-one
Also Known As: 4-Bromochalcone, 4'-Bromochalcone, (E)-4-Bromochalcone, 3-Methoxychalcone, (E)-3-(4-bromophenyl)-1-phenylprop-2-en-1-one
| Molecular Formula | C15H11BrO |
|---|---|
| Molecular Weight | 286.00 g/mol |
| LogP | 4.3452 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 285.99933 |
| Heavy Atoms | 17 |
| Complexity | 526.6081 |
Chemical Identifiers
| CAS Number | 18137-96-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)/C=C/C2=CC=C(C=C2)Br |
Product Overview
4-Bromochalcone (CAS 18137-96-7), with molecular formula C15H11BrO and molecular weight 286.00 g/mol. IUPAC: (E)-3-(4-bromophenyl)-1-phenylprop-2-en-1-one.
Chemical Property Profile of 4-Bromochalcone
Property Insights of 4-Bromochalcone
The XLogP value of 4.3452 indicates that 4-Bromochalcone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 4-Bromochalcone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromochalcone 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-Bromochalcone?
The CAS number of 4-Bromochalcone is 18137-96-7.
What is the molecular formula of 4-Bromochalcone?
The molecular formula of 4-Bromochalcone is C15H11BrO.
What is the molecular weight of 4-Bromochalcone?
The molecular weight of 4-Bromochalcone is 286.00 g/mol.
Where can I buy 4-Bromochalcone?
You can request a quote for 4-Bromochalcone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromochalcone?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromochalcone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.