四溴邻苯二甲酸酐
TL;DR: 四溴邻苯二甲酸酐 (CAS 632-79-1) is a chemical compound with molecular formula C8Br4O3 and molecular weight 459.66 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
四溴邻苯二甲酸酐
4,5,6,7-tetrabromo-2-benzofuran-1,3-dione
Also Known As: Tetrabromophthalic anhydride, Bromphthal, Bromophthal, Firemaster Pht4, FireMaster PHT 4
| Molecular Formula | C8Br4O3 |
|---|---|
| Molecular Weight | 459.66 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 463.654 |
| Heavy Atoms | 15 |
| Complexity | 291.0 |
| Melting Point | 535.1 to 280.5 °C |
| Solubility | Insoluble (NTP, 1992) |
| Vapor Pressure | 0.00000057 [mmHg] |
Chemical Identifiers
| CAS Number | 632-79-1 |
|---|---|
| SMILES | C12=C(C(=C(C(=C1Br)Br)Br)Br)C(=O)OC2=O |
| InChIKey | QHWKHLYUUZGSCW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
四溴邻苯二甲酸酐 (CAS 632-79-1), with molecular formula C8Br4O3 and molecular weight 459.66 g/mol. IUPAC: 4,5,6,7-tetrabromo-2-benzofuran-1,3-dione.
Chemical Property Profile of 四溴邻苯二甲酸酐
Property Insights of 四溴邻苯二甲酸酐
The XLogP value of 4.1 indicates that 四溴邻苯二甲酸酐 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, 四溴邻苯二甲酸酐 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 四溴邻苯二甲酸酐 has 0 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 四溴邻苯二甲酸酐?
The CAS number of 四溴邻苯二甲酸酐 is 632-79-1.
What is the molecular formula of 四溴邻苯二甲酸酐?
The molecular formula of 四溴邻苯二甲酸酐 is C8Br4O3.
What is the molecular weight of 四溴邻苯二甲酸酐?
The molecular weight of 四溴邻苯二甲酸酐 is 459.66 g/mol.
Where can I buy 四溴邻苯二甲酸酐?
You can request a quote for 四溴邻苯二甲酸酐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 四溴邻苯二甲酸酐?
Yes, KEHONG BIO provides custom synthesis services for 四溴邻苯二甲酸酐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.