3-(3-Bromophenyl)-6-chloro-4,7-dimethylchromen-2-one
TL;DR: 3-(3-Bromophenyl)-6-chloro-4,7-dimethylchromen-2-one (CAS 720673-84-7) is a chemical compound with molecular formula C17H12BrClO2 and molecular weight 361.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-bromophenyl)-6-chloro-4,7-dimethylchromen-2-one
Also Known As: 3(3'-Bromophenyl)-6-chloro-4,7-dimethylcoumarin, 3-(3-bromophenyl)-6-chloro-4,7-dimethylchromen-2-one, 3-(3'-Bromophenyl)-6-chloro-4,7-dimethylcoumarin, 3-(3-bromophenyl)-6-chloro-4,7-dimethyl-chromen-2-one, 3-(3 inverted exclamation mark -Bromophenyl)-6-chloro-4,7-dimethylcoumarin
| Molecular Formula | C17H12BrClO2 |
|---|---|
| Molecular Weight | 361.97 g/mol |
| LogP | 5.49274 |
| Topological Polar Surface Area | 30.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 361.97092 |
| Heavy Atoms | 21 |
| Complexity | 912.54254 |
Chemical Identifiers
| CAS Number | 720673-84-7 |
|---|---|
| SMILES | CC1=CC2=C(C=C1Cl)C(=C(C(=O)O2)C3=CC(=CC=C3)Br)C |
Product Overview
3-(3-Bromophenyl)-6-chloro-4,7-dimethylchromen-2-one (CAS 720673-84-7), with molecular formula C17H12BrClO2 and molecular weight 361.97 g/mol. IUPAC: 3-(3-bromophenyl)-6-chloro-4,7-dimethylchromen-2-one.
Chemical Property Profile of 3-(3-Bromophenyl)-6-chloro-4,7-dimethylchromen-2-one
Property Insights of 3-(3-Bromophenyl)-6-chloro-4,7-dimethylchromen-2-one
The XLogP value of 5.49274 indicates that 3-(3-Bromophenyl)-6-chloro-4,7-dimethylchromen-2-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, 3-(3-Bromophenyl)-6-chloro-4,7-dimethylchromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-Bromophenyl)-6-chloro-4,7-dimethylchromen-2-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(3-Bromophenyl)-6-chloro-4,7-dimethylchromen-2-one?
The CAS number of 3-(3-Bromophenyl)-6-chloro-4,7-dimethylchromen-2-one is 720673-84-7.
What is the molecular formula of 3-(3-Bromophenyl)-6-chloro-4,7-dimethylchromen-2-one?
The molecular formula of 3-(3-Bromophenyl)-6-chloro-4,7-dimethylchromen-2-one is C17H12BrClO2.
What is the molecular weight of 3-(3-Bromophenyl)-6-chloro-4,7-dimethylchromen-2-one?
The molecular weight of 3-(3-Bromophenyl)-6-chloro-4,7-dimethylchromen-2-one is 361.97 g/mol.
Where can I buy 3-(3-Bromophenyl)-6-chloro-4,7-dimethylchromen-2-one?
You can request a quote for 3-(3-Bromophenyl)-6-chloro-4,7-dimethylchromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-Bromophenyl)-6-chloro-4,7-dimethylchromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-Bromophenyl)-6-chloro-4,7-dimethylchromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.