3-Bromo-2,3-dimethylbutane-2-peroxol
TL;DR: 3-Bromo-2,3-dimethylbutane-2-peroxol (CAS 14112-16-4) is a chemical compound with molecular formula C6H13BrO2 and molecular weight 196.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-3-hydroperoxy-2,3-dimethylbutane
Also Known As: 3-Bromo-2,3-dimethylbutane-2-peroxol, 2-bromo-3-hydroperoxy-2,3-dimethylbutane, 3-Brom-2,3-dimethyl-2-hydroperoxybutan, RefChem:277232
| Molecular Formula | C6H13BrO2 |
|---|---|
| Molecular Weight | 196.01 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 196.00989 |
| Heavy Atoms | 9 |
| Complexity | 99.0 |
Chemical Identifiers
| CAS Number | 14112-16-4 |
|---|---|
| SMILES | CC(C)(C(C)(C)Br)OO |
| InChIKey | MBXXOJXUDWVVPQ-UHFFFAOYSA-N |
Product Overview
3-Bromo-2,3-dimethylbutane-2-peroxol (CAS 14112-16-4), with molecular formula C6H13BrO2 and molecular weight 196.01 g/mol. IUPAC: 2-bromo-3-hydroperoxy-2,3-dimethylbutane.
Chemical Property Profile of 3-Bromo-2,3-dimethylbutane-2-peroxol
Property Insights of 3-Bromo-2,3-dimethylbutane-2-peroxol
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Bromo-2,3-dimethylbutane-2-peroxol. With a topological polar surface area (TPSA) of 29.5 Ų, 3-Bromo-2,3-dimethylbutane-2-peroxol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Bromo-2,3-dimethylbutane-2-peroxol has 1 hydrogen bond donor(s) and 2 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 3-Bromo-2,3-dimethylbutane-2-peroxol?
The CAS number of 3-Bromo-2,3-dimethylbutane-2-peroxol is 14112-16-4.
What is the molecular formula of 3-Bromo-2,3-dimethylbutane-2-peroxol?
The molecular formula of 3-Bromo-2,3-dimethylbutane-2-peroxol is C6H13BrO2.
What is the molecular weight of 3-Bromo-2,3-dimethylbutane-2-peroxol?
The molecular weight of 3-Bromo-2,3-dimethylbutane-2-peroxol is 196.01 g/mol.
Where can I buy 3-Bromo-2,3-dimethylbutane-2-peroxol?
You can request a quote for 3-Bromo-2,3-dimethylbutane-2-peroxol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Bromo-2,3-dimethylbutane-2-peroxol?
Yes, KEHONG BIO provides custom synthesis services for 3-Bromo-2,3-dimethylbutane-2-peroxol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.