2-(3-bromophenyl)-6-chloro-4H-chromen-4-one
TL;DR: 2-(3-bromophenyl)-6-chloro-4H-chromen-4-one (CAS 213894-79-2) is a chemical compound with molecular formula C15H8BrClO2 and molecular weight 333.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-bromophenyl)-6-chlorochromen-4-one
Also Known As: 3 -Bromo-6-chloroflavone, 2-(3-bromophenyl)-6-chloro-4H-chromen-4-one, 2-(3-bromophenyl)-6-chlorochromen-4-one, 2-(3-Bromophenyl)-6-chloro-4H-1-benzopyran-4-one, AB01330140-02
| Molecular Formula | C15H8BrClO2 |
|---|---|
| Molecular Weight | 333.94 g/mol |
| LogP | 4.8759 |
| Topological Polar Surface Area | 30.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 333.9396 |
| Heavy Atoms | 19 |
| Complexity | 823.7337 |
Chemical Identifiers
| CAS Number | 213894-79-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Br)C2=CC(=O)C3=C(O2)C=CC(=C3)Cl |
Product Overview
2-(3-bromophenyl)-6-chloro-4H-chromen-4-one (CAS 213894-79-2), with molecular formula C15H8BrClO2 and molecular weight 333.94 g/mol. IUPAC: 2-(3-bromophenyl)-6-chlorochromen-4-one.
Chemical Property Profile of 2-(3-bromophenyl)-6-chloro-4H-chromen-4-one
Property Insights of 2-(3-bromophenyl)-6-chloro-4H-chromen-4-one
The XLogP value of 4.8759 indicates that 2-(3-bromophenyl)-6-chloro-4H-chromen-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.21 Ų, 2-(3-bromophenyl)-6-chloro-4H-chromen-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-bromophenyl)-6-chloro-4H-chromen-4-one has 0 hydrogen bond donor(s) and 2 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 2-(3-bromophenyl)-6-chloro-4H-chromen-4-one?
The CAS number of 2-(3-bromophenyl)-6-chloro-4H-chromen-4-one is 213894-79-2.
What is the molecular formula of 2-(3-bromophenyl)-6-chloro-4H-chromen-4-one?
The molecular formula of 2-(3-bromophenyl)-6-chloro-4H-chromen-4-one is C15H8BrClO2.
What is the molecular weight of 2-(3-bromophenyl)-6-chloro-4H-chromen-4-one?
The molecular weight of 2-(3-bromophenyl)-6-chloro-4H-chromen-4-one is 333.94 g/mol.
Where can I buy 2-(3-bromophenyl)-6-chloro-4H-chromen-4-one?
You can request a quote for 2-(3-bromophenyl)-6-chloro-4H-chromen-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-bromophenyl)-6-chloro-4H-chromen-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-bromophenyl)-6-chloro-4H-chromen-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.