Isopropyl 2-bromo-2-methylpropionate
TL;DR: Isopropyl 2-bromo-2-methylpropionate (CAS 51368-55-9) is a chemical compound with molecular formula C7H13BrO2 and molecular weight 208.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2-bromo-2-methylpropanoate
Also Known As: ISOPROPYL 2-BROMO-2-METHYLPROPANOATE, Isopropyl 2-bromo-2-methylpropionate, isopropyl 2-bromoisobutyrate, propan-2-yl 2-bromo-2-methylpropanoate, 2-Bromo-2-methylpropionic acid isopropyl ester
| Molecular Formula | C7H13BrO2 |
|---|---|
| Molecular Weight | 208.01 g/mol |
| LogP | 2.1115 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.00989 |
| Heavy Atoms | 10 |
| Complexity | 124.05802 |
Chemical Identifiers
| CAS Number | 51368-55-9 |
|---|---|
| SMILES | CC(C)OC(=O)C(C)(C)Br |
Product Overview
Isopropyl 2-bromo-2-methylpropionate (CAS 51368-55-9), with molecular formula C7H13BrO2 and molecular weight 208.01 g/mol. IUPAC: propan-2-yl 2-bromo-2-methylpropanoate.
Chemical Property Profile of Isopropyl 2-bromo-2-methylpropionate
Property Insights of Isopropyl 2-bromo-2-methylpropionate
The XLogP value of 2.1115 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isopropyl 2-bromo-2-methylpropionate. With a topological polar surface area (TPSA) of 26.3 Ų, Isopropyl 2-bromo-2-methylpropionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isopropyl 2-bromo-2-methylpropionate has 0 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 Isopropyl 2-bromo-2-methylpropionate?
The CAS number of Isopropyl 2-bromo-2-methylpropionate is 51368-55-9.
What is the molecular formula of Isopropyl 2-bromo-2-methylpropionate?
The molecular formula of Isopropyl 2-bromo-2-methylpropionate is C7H13BrO2.
What is the molecular weight of Isopropyl 2-bromo-2-methylpropionate?
The molecular weight of Isopropyl 2-bromo-2-methylpropionate is 208.01 g/mol.
Where can I buy Isopropyl 2-bromo-2-methylpropionate?
You can request a quote for Isopropyl 2-bromo-2-methylpropionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isopropyl 2-bromo-2-methylpropionate?
Yes, KEHONG BIO provides custom synthesis services for Isopropyl 2-bromo-2-methylpropionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.