3-Bromo-2-methyl-2-butanol
TL;DR: 3-Bromo-2-methyl-2-butanol (CAS 2588-77-4) is a chemical compound with molecular formula C5H11BrO and molecular weight 166.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-2-methylbutan-2-ol
Also Known As: 2-Methyl-3-bromo-2-butanol, 3-bromo-2-methylbutan-2-ol, 3-Bromo-2-methyl-2-butanol, 3-bromo-2-methyl-butan-2-ol, 2-butanol, 3-bromo-2-methyl-
| Molecular Formula | C5H11BrO |
|---|---|
| Molecular Weight | 166.00 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 165.99933 |
| Heavy Atoms | 7 |
| Complexity | 61.0 |
Chemical Identifiers
| CAS Number | 2588-77-4 |
|---|---|
| SMILES | CC(C(C)(C)O)Br |
| InChIKey | YGHWXEJVGBPVSX-UHFFFAOYSA-N |
Product Overview
3-Bromo-2-methyl-2-butanol (CAS 2588-77-4), with molecular formula C5H11BrO and molecular weight 166.00 g/mol. IUPAC: 3-bromo-2-methylbutan-2-ol.
Chemical Property Profile of 3-Bromo-2-methyl-2-butanol
Property Insights of 3-Bromo-2-methyl-2-butanol
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Bromo-2-methyl-2-butanol. With a topological polar surface area (TPSA) of 20.2 Ų, 3-Bromo-2-methyl-2-butanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Bromo-2-methyl-2-butanol has 1 hydrogen bond donor(s) and 1 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-methyl-2-butanol?
The CAS number of 3-Bromo-2-methyl-2-butanol is 2588-77-4.
What is the molecular formula of 3-Bromo-2-methyl-2-butanol?
The molecular formula of 3-Bromo-2-methyl-2-butanol is C5H11BrO.
What is the molecular weight of 3-Bromo-2-methyl-2-butanol?
The molecular weight of 3-Bromo-2-methyl-2-butanol is 166.00 g/mol.
Where can I buy 3-Bromo-2-methyl-2-butanol?
You can request a quote for 3-Bromo-2-methyl-2-butanol 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-methyl-2-butanol?
Yes, KEHONG BIO provides custom synthesis services for 3-Bromo-2-methyl-2-butanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.