(2,4,6-Tribromophenoxy)acetic acid
TL;DR: (2,4,6-Tribromophenoxy)acetic acid (CAS 84998-84-5) is a chemical compound with molecular formula C8H5Br3O3 and molecular weight 385.78 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,4,6-tribromophenoxy)acetic acid
Also Known As: NCIOpen2_007667, (2,4,6-Tribromophenoxy)acetic acid, 2-(2,4,6-tribromophenoxy)acetic acid, 2,4,6-tribromophenoxyacetic acid, Acetic acid,2-(2,4,6-tribromophenoxy)-
| Molecular Formula | C8H5Br3O3 |
|---|---|
| Molecular Weight | 385.78 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 385.77887 |
| Heavy Atoms | 14 |
| Complexity | 200.0 |
Chemical Identifiers
| CAS Number | 84998-84-5 |
|---|---|
| SMILES | C1=C(C=C(C(=C1Br)OCC(=O)O)Br)Br |
| InChIKey | NZVKXRXUNGXULQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(2,4,6-Tribromophenoxy)acetic acid (CAS 84998-84-5), with molecular formula C8H5Br3O3 and molecular weight 385.78 g/mol. IUPAC: 2-(2,4,6-tribromophenoxy)acetic acid.
Chemical Property Profile of (2,4,6-Tribromophenoxy)acetic acid
Property Insights of (2,4,6-Tribromophenoxy)acetic acid
The XLogP value of 3.6 indicates that (2,4,6-Tribromophenoxy)acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, (2,4,6-Tribromophenoxy)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2,4,6-Tribromophenoxy)acetic acid has 1 hydrogen bond donor(s) and 3 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 (2,4,6-Tribromophenoxy)acetic acid?
The CAS number of (2,4,6-Tribromophenoxy)acetic acid is 84998-84-5.
What is the molecular formula of (2,4,6-Tribromophenoxy)acetic acid?
The molecular formula of (2,4,6-Tribromophenoxy)acetic acid is C8H5Br3O3.
What is the molecular weight of (2,4,6-Tribromophenoxy)acetic acid?
The molecular weight of (2,4,6-Tribromophenoxy)acetic acid is 385.78 g/mol.
Where can I buy (2,4,6-Tribromophenoxy)acetic acid?
You can request a quote for (2,4,6-Tribromophenoxy)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2,4,6-Tribromophenoxy)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (2,4,6-Tribromophenoxy)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.