2,4,6-Tris(2-bromopropan-2-yl)-1,3,5-trioxane
TL;DR: 2,4,6-Tris(2-bromopropan-2-yl)-1,3,5-trioxane (CAS 7472-00-6) is a chemical compound with molecular formula C12H21Br3O3 and molecular weight 449.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,6-tris(2-bromopropan-2-yl)-1,3,5-trioxane
Also Known As: 2,4,6-tris(2-bromopropan-2-yl)-1,3,5-trioxane, 1L-018, 2,4,6-tris(1-bromo-1-methylethyl)-1,3,5-trioxane, (2R)-2,4,6-TRIS(1-BROMO-1-METHYLETHYL)-1,3,5-TRIOXANE
| Molecular Formula | C12H21Br3O3 |
|---|---|
| Molecular Weight | 449.90 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 449.90408 |
| Heavy Atoms | 18 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 7472-00-6 |
|---|---|
| SMILES | CC(C)(C1OC(OC(O1)C(C)(C)Br)C(C)(C)Br)Br |
| InChIKey | KTNYNRJPTHZVNU-UHFFFAOYSA-N |
Product Overview
2,4,6-Tris(2-bromopropan-2-yl)-1,3,5-trioxane (CAS 7472-00-6), with molecular formula C12H21Br3O3 and molecular weight 449.90 g/mol. IUPAC: 2,4,6-tris(2-bromopropan-2-yl)-1,3,5-trioxane.
Chemical Property Profile of 2,4,6-Tris(2-bromopropan-2-yl)-1,3,5-trioxane
Property Insights of 2,4,6-Tris(2-bromopropan-2-yl)-1,3,5-trioxane
The XLogP value of 4.2 indicates that 2,4,6-Tris(2-bromopropan-2-yl)-1,3,5-trioxane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.7 Ų, 2,4,6-Tris(2-bromopropan-2-yl)-1,3,5-trioxane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,6-Tris(2-bromopropan-2-yl)-1,3,5-trioxane 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 2,4,6-Tris(2-bromopropan-2-yl)-1,3,5-trioxane?
The CAS number of 2,4,6-Tris(2-bromopropan-2-yl)-1,3,5-trioxane is 7472-00-6.
What is the molecular formula of 2,4,6-Tris(2-bromopropan-2-yl)-1,3,5-trioxane?
The molecular formula of 2,4,6-Tris(2-bromopropan-2-yl)-1,3,5-trioxane is C12H21Br3O3.
What is the molecular weight of 2,4,6-Tris(2-bromopropan-2-yl)-1,3,5-trioxane?
The molecular weight of 2,4,6-Tris(2-bromopropan-2-yl)-1,3,5-trioxane is 449.90 g/mol.
Where can I buy 2,4,6-Tris(2-bromopropan-2-yl)-1,3,5-trioxane?
You can request a quote for 2,4,6-Tris(2-bromopropan-2-yl)-1,3,5-trioxane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,6-Tris(2-bromopropan-2-yl)-1,3,5-trioxane?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-Tris(2-bromopropan-2-yl)-1,3,5-trioxane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.