2-Bromo-1,1-diethoxypropane
TL;DR: 2-Bromo-1,1-diethoxypropane (CAS 3400-55-3) is a chemical compound with molecular formula C7H15BrO2 and molecular weight 210.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-1,1-diethoxypropane
Also Known As: 2-Bromo-1,1-diethoxypropane, 2-Bromopriopionaldehydediethylacetal, 2-bromopropionaldehyde diethyl acetal, Propane, 2-bromo-1,1-diethoxy-, starbld0016321
| Molecular Formula | C7H15BrO2 |
|---|---|
| Molecular Weight | 210.03 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 210.02554 |
| Heavy Atoms | 10 |
| Complexity | 72.0 |
Chemical Identifiers
| CAS Number | 3400-55-3 |
|---|---|
| SMILES | CCOC(C(C)Br)OCC |
| InChIKey | AHIUAFXWZKCJLR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Bromo-1,1-diethoxypropane (CAS 3400-55-3), with molecular formula C7H15BrO2 and molecular weight 210.03 g/mol. IUPAC: 2-bromo-1,1-diethoxypropane.
Chemical Property Profile of 2-Bromo-1,1-diethoxypropane
Property Insights of 2-Bromo-1,1-diethoxypropane
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromo-1,1-diethoxypropane. With a topological polar surface area (TPSA) of 18.5 Ų, 2-Bromo-1,1-diethoxypropane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-1,1-diethoxypropane 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 2-Bromo-1,1-diethoxypropane?
The CAS number of 2-Bromo-1,1-diethoxypropane is 3400-55-3.
What is the molecular formula of 2-Bromo-1,1-diethoxypropane?
The molecular formula of 2-Bromo-1,1-diethoxypropane is C7H15BrO2.
What is the molecular weight of 2-Bromo-1,1-diethoxypropane?
The molecular weight of 2-Bromo-1,1-diethoxypropane is 210.03 g/mol.
Where can I buy 2-Bromo-1,1-diethoxypropane?
You can request a quote for 2-Bromo-1,1-diethoxypropane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-1,1-diethoxypropane?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-1,1-diethoxypropane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.