Tris(1,3-dichloro-2-propyl) phosphate
TL;DR: Tris(1,3-dichloro-2-propyl) phosphate (CAS 13674-87-8) is a chemical compound with molecular formula C9H15Cl6O4P and molecular weight 427.8839 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tris(1,3-dichloropropan-2-yl) phosphate
Also Known As: TDCPP, Fyrol FR 2, Emulsion 212, Tris(1,3-dichloro-2-propyl)phosphate, TDCIPP
Application Areas
Top 5 of 12 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H15Cl6O4P |
| Molecular Weight | 427.8839 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 429.88095 Da |
| Heavy Atoms | 20 |
| Complexity | 243.0 |
| Boiling Point | 457 to 459 °F at 5 mmHg (NTP, 1992) |
| Density | 1.508 at 72 °F (NTP, 1992) - Denser than water; will sink |
| Flash Point | 485 °F (NTP, 1992) |
| Vapor Pressure | 10.3 mmHg at 77 °F (NTP, 1992) |
| Refractive Index | Index of refraction: 1.5022 at 20 °C |
| Solubility | less than 1 mg/mL at 75 °F (NTP, 1992) |
| SMILES | C(C(CCl)OP(=O)(OC(CCl)CCl)OC(CCl)CCl)Cl |
| InChIKey | ASLWPAWFJZFCKF-UHFFFAOYSA-N |
Chemical Property Profile of Tris(1,3-dichloro-2-propyl) phosphate
Property Insights of Tris(1,3-dichloro-2-propyl) phosphate
The XLogP value of 3.3 indicates that Tris(1,3-dichloro-2-propyl) phosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, Tris(1,3-dichloro-2-propyl) phosphate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tris(1,3-dichloro-2-propyl) phosphate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Tris(1,3-dichloro-2-propyl) phosphate?
The CAS number of Tris(1,3-dichloro-2-propyl) phosphate is 13674-87-8.
What is the molecular formula of Tris(1,3-dichloro-2-propyl) phosphate?
The molecular formula of Tris(1,3-dichloro-2-propyl) phosphate is C9H15Cl6O4P.
What is the molecular weight of Tris(1,3-dichloro-2-propyl) phosphate?
The molecular weight of Tris(1,3-dichloro-2-propyl) phosphate is 427.8839 g/mol.
Where can I buy Tris(1,3-dichloro-2-propyl) phosphate?
You can request a quote for Tris(1,3-dichloro-2-propyl) phosphate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Tris(1,3-dichloro-2-propyl) phosphate?
Yes, CoreyChem provides custom synthesis services for Tris(1,3-dichloro-2-propyl) phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.