Allyl 2,4,6-tribromophenyl ether
TL;DR: Allyl 2,4,6-tribromophenyl ether (CAS 3278-89-5) is a chemical compound with molecular formula C9H7Br3O and molecular weight 367.80 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,5-tribromo-2-prop-2-enoxybenzene
Also Known As: Allyl 2,4,6-tribromophenyl ether, TBP-AE, 2-ALLYLOXY-1,3,5-TRIBROMOBENZENE, Great lakes PHE-65, 2,4,6-tribromophenyl allyl ether
| Molecular Formula | C9H7Br3O |
|---|---|
| Molecular Weight | 367.80 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 369.80264 |
| Heavy Atoms | 13 |
| Complexity | 162.0 |
Chemical Identifiers
| CAS Number | 3278-89-5 |
|---|---|
| SMILES | C=CCOC1=C(C=C(C=C1Br)Br)Br |
| InChIKey | RZLLIOPGUFOWOD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Allyl 2,4,6-tribromophenyl ether (CAS 3278-89-5), with molecular formula C9H7Br3O and molecular weight 367.80 g/mol. IUPAC: 1,3,5-tribromo-2-prop-2-enoxybenzene.
Chemical Property Profile of Allyl 2,4,6-tribromophenyl ether
Property Insights of Allyl 2,4,6-tribromophenyl ether
The XLogP value of 4.7 indicates that Allyl 2,4,6-tribromophenyl ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, Allyl 2,4,6-tribromophenyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Allyl 2,4,6-tribromophenyl ether has 0 hydrogen bond donor(s) and 1 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 Allyl 2,4,6-tribromophenyl ether?
The CAS number of Allyl 2,4,6-tribromophenyl ether is 3278-89-5.
What is the molecular formula of Allyl 2,4,6-tribromophenyl ether?
The molecular formula of Allyl 2,4,6-tribromophenyl ether is C9H7Br3O.
What is the molecular weight of Allyl 2,4,6-tribromophenyl ether?
The molecular weight of Allyl 2,4,6-tribromophenyl ether is 367.80 g/mol.
Where can I buy Allyl 2,4,6-tribromophenyl ether?
You can request a quote for Allyl 2,4,6-tribromophenyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Allyl 2,4,6-tribromophenyl ether?
Yes, KEHONG BIO provides custom synthesis services for Allyl 2,4,6-tribromophenyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.