4-Bromo-1-naphthyl (4-chlorophenoxy)acetate
TL;DR: 4-Bromo-1-naphthyl (4-chlorophenoxy)acetate (CAS 433307-55-2) is a chemical compound with molecular formula C18H12BrClO3 and molecular weight 389.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromonaphthalen-1-yl) 2-(4-chlorophenoxy)acetate
Also Known As: 4-bromo-1-naphthyl (4-chlorophenoxy)acetate, 4-bromonaphthyl 2-(4-chlorophenoxy)acetate, (4-bromonaphthalen-1-yl) 2-(4-chlorophenoxy)acetate, 4-bromonaphthalen-1-yl (4-chlorophenoxy)acetate, AN-329/40887444
| Molecular Formula | C18H12BrClO3 |
|---|---|
| Molecular Weight | 389.97 g/mol |
| LogP | 5.2401 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 389.96582 |
| Heavy Atoms | 23 |
| Complexity | 846.5145 |
Chemical Identifiers
| CAS Number | 433307-55-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC=C2Br)OC(=O)COC3=CC=C(C=C3)Cl |
Product Overview
4-Bromo-1-naphthyl (4-chlorophenoxy)acetate (CAS 433307-55-2), with molecular formula C18H12BrClO3 and molecular weight 389.97 g/mol. IUPAC: (4-bromonaphthalen-1-yl) 2-(4-chlorophenoxy)acetate.
Chemical Property Profile of 4-Bromo-1-naphthyl (4-chlorophenoxy)acetate
Property Insights of 4-Bromo-1-naphthyl (4-chlorophenoxy)acetate
The XLogP value of 5.2401 indicates that 4-Bromo-1-naphthyl (4-chlorophenoxy)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, 4-Bromo-1-naphthyl (4-chlorophenoxy)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-1-naphthyl (4-chlorophenoxy)acetate 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 4-Bromo-1-naphthyl (4-chlorophenoxy)acetate?
The CAS number of 4-Bromo-1-naphthyl (4-chlorophenoxy)acetate is 433307-55-2.
What is the molecular formula of 4-Bromo-1-naphthyl (4-chlorophenoxy)acetate?
The molecular formula of 4-Bromo-1-naphthyl (4-chlorophenoxy)acetate is C18H12BrClO3.
What is the molecular weight of 4-Bromo-1-naphthyl (4-chlorophenoxy)acetate?
The molecular weight of 4-Bromo-1-naphthyl (4-chlorophenoxy)acetate is 389.97 g/mol.
Where can I buy 4-Bromo-1-naphthyl (4-chlorophenoxy)acetate?
You can request a quote for 4-Bromo-1-naphthyl (4-chlorophenoxy)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-1-naphthyl (4-chlorophenoxy)acetate?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-1-naphthyl (4-chlorophenoxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.