![7-[(4-bromobenzyl)oxy]-6-chloro-4-ethyl-2H-chromen-2-one structure](/static/products/4389/4389-20-2.webp)
7-[(4-bromobenzyl)oxy]-6-chloro-4-ethyl-2H-chromen-2-one
TL;DR: 7-[(4-bromobenzyl)oxy]-6-chloro-4-ethyl-2H-chromen-2-one (CAS 4389-20-2) is a chemical compound with molecular formula C18H14BrClO3 and molecular weight 391.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(4-bromophenyl)methoxy]-6-chloro-4-ethylchromen-2-one
Also Known As: 7-[(4-bromobenzyl)oxy]-6-chloro-4-ethyl-2H-chromen-2-one, 7-[(4-bromophenyl)methoxy]-6-chloro-4-ethylchromen-2-one, 7-[(4-Bromophenyl)methoxy]-6-chloro-4-ethyl-2H-1-benzopyran-2-one, 7-[(4-BROMOPHENYL)METHOXY]-6-CHLORO-4-ETHYL-2H-CHROMEN-2-ONE
| Molecular Formula | C18H14BrClO3 |
|---|---|
| Molecular Weight | 391.98 g/mol |
| LogP | 5.3503 |
| Topological Polar Surface Area | 39.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 391.98148 |
| Heavy Atoms | 23 |
| Complexity | 900.52405 |
Chemical Identifiers
| CAS Number | 4389-20-2 |
|---|---|
| SMILES | CCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC3=CC=C(C=C3)Br |
Product Overview
7-[(4-bromobenzyl)oxy]-6-chloro-4-ethyl-2H-chromen-2-one (CAS 4389-20-2), with molecular formula C18H14BrClO3 and molecular weight 391.98 g/mol. IUPAC: 7-[(4-bromophenyl)methoxy]-6-chloro-4-ethylchromen-2-one.
Chemical Property Profile of 7-[(4-bromobenzyl)oxy]-6-chloro-4-ethyl-2H-chromen-2-one
Property Insights of 7-[(4-bromobenzyl)oxy]-6-chloro-4-ethyl-2H-chromen-2-one
The XLogP value of 5.3503 indicates that 7-[(4-bromobenzyl)oxy]-6-chloro-4-ethyl-2H-chromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.44 Ų, 7-[(4-bromobenzyl)oxy]-6-chloro-4-ethyl-2H-chromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-[(4-bromobenzyl)oxy]-6-chloro-4-ethyl-2H-chromen-2-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7-[(4-bromobenzyl)oxy]-6-chloro-4-ethyl-2H-chromen-2-one?
The CAS number of 7-[(4-bromobenzyl)oxy]-6-chloro-4-ethyl-2H-chromen-2-one is 4389-20-2.
What is the molecular formula of 7-[(4-bromobenzyl)oxy]-6-chloro-4-ethyl-2H-chromen-2-one?
The molecular formula of 7-[(4-bromobenzyl)oxy]-6-chloro-4-ethyl-2H-chromen-2-one is C18H14BrClO3.
What is the molecular weight of 7-[(4-bromobenzyl)oxy]-6-chloro-4-ethyl-2H-chromen-2-one?
The molecular weight of 7-[(4-bromobenzyl)oxy]-6-chloro-4-ethyl-2H-chromen-2-one is 391.98 g/mol.
Where can I buy 7-[(4-bromobenzyl)oxy]-6-chloro-4-ethyl-2H-chromen-2-one?
You can request a quote for 7-[(4-bromobenzyl)oxy]-6-chloro-4-ethyl-2H-chromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-[(4-bromobenzyl)oxy]-6-chloro-4-ethyl-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 7-[(4-bromobenzyl)oxy]-6-chloro-4-ethyl-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.