1-Bromo-2,2-dimethoxypropane
TL;DR: 1-Bromo-2,2-dimethoxypropane (CAS 126-38-5) is a chemical compound with molecular formula C5H11BrO2 and molecular weight 181.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-2,2-dimethoxypropane
Also Known As: 1-Bromo-2,2-dimethoxypropane, n-isoamylaniline, Propane, 1-bromo-2,2-dimethoxy-, 1-Bromo-2,2-dimethoxyprpopane, 1-bromo-2,2-dimethoxy-propane
| Molecular Formula | C5H11BrO2 |
|---|---|
| Molecular Weight | 181.99 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 181.99425 |
| Heavy Atoms | 8 |
| Complexity | 61.0 |
Chemical Identifiers
| CAS Number | 126-38-5 |
|---|---|
| SMILES | CC(CBr)(OC)OC |
| InChIKey | SGTITUFGCGGICE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Bromo-2,2-dimethoxypropane (CAS 126-38-5), with molecular formula C5H11BrO2 and molecular weight 181.99 g/mol. IUPAC: 1-bromo-2,2-dimethoxypropane.
Chemical Property Profile of 1-Bromo-2,2-dimethoxypropane
Property Insights of 1-Bromo-2,2-dimethoxypropane
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Bromo-2,2-dimethoxypropane. With a topological polar surface area (TPSA) of 18.5 Ų, 1-Bromo-2,2-dimethoxypropane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-2,2-dimethoxypropane 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 1-Bromo-2,2-dimethoxypropane?
The CAS number of 1-Bromo-2,2-dimethoxypropane is 126-38-5.
What is the molecular formula of 1-Bromo-2,2-dimethoxypropane?
The molecular formula of 1-Bromo-2,2-dimethoxypropane is C5H11BrO2.
What is the molecular weight of 1-Bromo-2,2-dimethoxypropane?
The molecular weight of 1-Bromo-2,2-dimethoxypropane is 181.99 g/mol.
Where can I buy 1-Bromo-2,2-dimethoxypropane?
You can request a quote for 1-Bromo-2,2-dimethoxypropane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromo-2,2-dimethoxypropane?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-2,2-dimethoxypropane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.