4-Bromobenzophenone
TL;DR: 4-Bromobenzophenone (CAS 90-90-4) is a chemical compound with molecular formula C13H9BrO and molecular weight 259.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromophenyl)-phenylmethanone
Also Known As: 4-Bromobenzophenone, (4-Bromophenyl)(phenyl)methanone, p-Bromobenzophenone, p-Benzoylbromobenzene, Methanone, (4-bromophenyl)phenyl-
| Molecular Formula | C13H9BrO |
|---|---|
| Molecular Weight | 259.98 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 259.98367 |
| Heavy Atoms | 15 |
| Complexity | 213.0 |
Chemical Identifiers
| CAS Number | 90-90-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)Br |
| InChIKey | KEOLYBMGRQYQTN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Bromobenzophenone (CAS 90-90-4), with molecular formula C13H9BrO and molecular weight 259.98 g/mol. IUPAC: (4-bromophenyl)-phenylmethanone.
Chemical Property Profile of 4-Bromobenzophenone
Property Insights of 4-Bromobenzophenone
The XLogP value of 4.1 indicates that 4-Bromobenzophenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 4-Bromobenzophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromobenzophenone 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-Bromobenzophenone?
The CAS number of 4-Bromobenzophenone is 90-90-4.
What is the molecular formula of 4-Bromobenzophenone?
The molecular formula of 4-Bromobenzophenone is C13H9BrO.
What is the molecular weight of 4-Bromobenzophenone?
The molecular weight of 4-Bromobenzophenone is 259.98 g/mol.
Where can I buy 4-Bromobenzophenone?
You can request a quote for 4-Bromobenzophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromobenzophenone?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromobenzophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.