磷酸三(2,3-二溴丙基)酯
TL;DR: 磷酸三(2,3-二溴丙基)酯 (CAS 126-72-7) is a chemical compound with molecular formula C9H15Br6O4P and molecular weight 691.58 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
磷酸三(2,3-二溴丙基)酯
tris(2,3-dibromopropyl) phosphate
Also Known As: Tris, Tris(2,3-dibromopropyl) phosphate, TDBPP, Flacavon R, Flammex AP
| Molecular Formula | C9H15Br6O4P |
|---|---|
| Molecular Weight | 691.58 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 697.57465 |
| Heavy Atoms | 20 |
| Complexity | 255.0 |
| Melting Point | FP: 5.5 °C |
| Density | 2.27 at 25.0 °C |
| Solubility | less than 1 mg/mL at 68 °F (NTP, 1992) |
| Flash Point | greater than 112.2 °C |
| Vapor Pressure | 0.00019 mmHg at 25.0 °C |
| Refractive Index | 1.5772 @ 20 °C |
Chemical Identifiers
| CAS Number | 126-72-7 |
|---|---|
| SMILES | C(C(CBr)Br)OP(=O)(OCC(CBr)Br)OCC(CBr)Br |
| InChIKey | PQYJRMFWJJONBO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
磷酸三(2,3-二溴丙基)酯 (CAS 126-72-7), with molecular formula C9H15Br6O4P and molecular weight 691.58 g/mol. IUPAC: tris(2,3-dibromopropyl) phosphate.
Chemical Property Profile of 磷酸三(2,3-二溴丙基)酯
Property Insights of 磷酸三(2,3-二溴丙基)酯
The XLogP value of 4.3 indicates that 磷酸三(2,3-二溴丙基)酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, 磷酸三(2,3-二溴丙基)酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 磷酸三(2,3-二溴丙基)酯 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 磷酸三(2,3-二溴丙基)酯?
The CAS number of 磷酸三(2,3-二溴丙基)酯 is 126-72-7.
What is the molecular formula of 磷酸三(2,3-二溴丙基)酯?
The molecular formula of 磷酸三(2,3-二溴丙基)酯 is C9H15Br6O4P.
What is the molecular weight of 磷酸三(2,3-二溴丙基)酯?
The molecular weight of 磷酸三(2,3-二溴丙基)酯 is 691.58 g/mol.
Where can I buy 磷酸三(2,3-二溴丙基)酯?
You can request a quote for 磷酸三(2,3-二溴丙基)酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 磷酸三(2,3-二溴丙基)酯?
Yes, KEHONG BIO provides custom synthesis services for 磷酸三(2,3-二溴丙基)酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.