Tris(3,4-dibromo-2-butyl)phosphate
TL;DR: Tris(3,4-dibromo-2-butyl)phosphate (CAS 111712-49-3) is a chemical compound with molecular formula C12H21Br6O4P and molecular weight 733.62775 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tris(3,4-dibromobutan-2-yl) phosphate
Also Known As: Tris(3,4-dibromo-2-butyl)phosphate, 2-Butanol, 3,4-dibromo-, phosphate (3:1), Phosphoric acid, tris(3,4-dibromo-2-butyl)-, tris(3,4-dibromobutan-2-yl) phosphate, Tris(3,4-dibromo-2-butyl) phosphoric acid
Technical Specifications
| Molecular Formula | C12H21Br6O4P |
| Molecular Weight | 733.62775 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 733.62775 Da |
| Heavy Atoms | 23 |
| Complexity | 325.0 |
| SMILES | CC(C(CBr)Br)OP(=O)(OC(C)C(CBr)Br)OC(C)C(CBr)Br |
| InChIKey | ICCFTYGDDNSVOD-UHFFFAOYSA-N |
Product Description
Applications: Tris(3,4-dibromo-2-butyl)phosphate is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Tris(3,4-dibromo-2-butyl)phosphate is a fine chemical identified by CAS number 111712-49-3 and the molecular formula C12H21Br6O4P and a molecular weight of 733.63 g/mol. Synonyms include ACMC-20d3co and Tris(3,4-dibromo-2-butyl)phosphate.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Tris(3,4-dibromo-2-butyl)phosphate
Property Insights of Tris(3,4-dibromo-2-butyl)phosphate
The XLogP value of 5.6 indicates that Tris(3,4-dibromo-2-butyl)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(3,4-dibromo-2-butyl)phosphate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tris(3,4-dibromo-2-butyl)phosphate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Tris(3,4-dibromo-2-butyl)phosphate?
The CAS number of Tris(3,4-dibromo-2-butyl)phosphate is 111712-49-3.
What is the molecular formula of Tris(3,4-dibromo-2-butyl)phosphate?
The molecular formula of Tris(3,4-dibromo-2-butyl)phosphate is C12H21Br6O4P.
What is the molecular weight of Tris(3,4-dibromo-2-butyl)phosphate?
The molecular weight of Tris(3,4-dibromo-2-butyl)phosphate is 733.62775 g/mol.
What are the applications of Tris(3,4-dibromo-2-butyl)phosphate?
Tris(3,4-dibromo-2-butyl)phosphate is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA,...
Where can I buy Tris(3,4-dibromo-2-butyl)phosphate?
You can request a quote for Tris(3,4-dibromo-2-butyl)phosphate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Tris(3,4-dibromo-2-butyl)phosphate?
Yes, CoreyChem provides custom synthesis services for Tris(3,4-dibromo-2-butyl)phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.