2,6,7-Trioxabicyclo(2.2.2)octane, 4-bromomethyl-1-methyl-
TL;DR: 2,6,7-Trioxabicyclo(2.2.2)octane, 4-bromomethyl-1-methyl- (CAS 60028-14-0) is a chemical compound with molecular formula C7H11BrO3 and molecular weight 221.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(bromomethyl)-1-methyl-2,6,7-trioxabicyclo[2.2.2]octane
Also Known As: 4-Bromomethyl-1-methyl-2,6,7-trioxabicyclo(2.2.2)octane, 2,6,7-Trioxabicyclo(2.2.2)octane, 4-bromomethyl-1-methyl-, 4-(bromomethyl)-1-methyl-2,6,7-trioxabicyclo[2.2.2]octane, 4-Bromomethyl-1-methyl-2,6,7-trioxabicyclo[2.2.2]octane, 2,6,7-Trioxabicyclo(2.2.2)octane,4-bromomethyl-1-methyl
| Molecular Formula | C7H11BrO3 |
|---|---|
| Molecular Weight | 221.99 g/mol |
| LogP | 1.1184 |
| Topological Polar Surface Area | 27.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 221.98917 |
| Heavy Atoms | 11 |
| Complexity | 146.53929 |
Chemical Identifiers
| CAS Number | 60028-14-0 |
|---|---|
| SMILES | CC12OCC(CO1)(CO2)CBr |
Product Overview
2,6,7-Trioxabicyclo(2.2.2)octane, 4-bromomethyl-1-methyl- (CAS 60028-14-0), with molecular formula C7H11BrO3 and molecular weight 221.99 g/mol. IUPAC: 4-(bromomethyl)-1-methyl-2,6,7-trioxabicyclo[2.2.2]octane.
Chemical Property Profile of 2,6,7-Trioxabicyclo(2.2.2)octane, 4-bromomethyl-1-methyl-
Property Insights of 2,6,7-Trioxabicyclo(2.2.2)octane, 4-bromomethyl-1-methyl-
The XLogP value of 1.1184 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6,7-Trioxabicyclo(2.2.2)octane, 4-bromomethyl-1-methyl-. With a topological polar surface area (TPSA) of 27.69 Ų, 2,6,7-Trioxabicyclo(2.2.2)octane, 4-bromomethyl-1-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6,7-Trioxabicyclo(2.2.2)octane, 4-bromomethyl-1-methyl- 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 2,6,7-Trioxabicyclo(2.2.2)octane, 4-bromomethyl-1-methyl-?
The CAS number of 2,6,7-Trioxabicyclo(2.2.2)octane, 4-bromomethyl-1-methyl- is 60028-14-0.
What is the molecular formula of 2,6,7-Trioxabicyclo(2.2.2)octane, 4-bromomethyl-1-methyl-?
The molecular formula of 2,6,7-Trioxabicyclo(2.2.2)octane, 4-bromomethyl-1-methyl- is C7H11BrO3.
What is the molecular weight of 2,6,7-Trioxabicyclo(2.2.2)octane, 4-bromomethyl-1-methyl-?
The molecular weight of 2,6,7-Trioxabicyclo(2.2.2)octane, 4-bromomethyl-1-methyl- is 221.99 g/mol.
Where can I buy 2,6,7-Trioxabicyclo(2.2.2)octane, 4-bromomethyl-1-methyl-?
You can request a quote for 2,6,7-Trioxabicyclo(2.2.2)octane, 4-bromomethyl-1-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6,7-Trioxabicyclo(2.2.2)octane, 4-bromomethyl-1-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 2,6,7-Trioxabicyclo(2.2.2)octane, 4-bromomethyl-1-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.