2-(4-Bromobutyl)-2-ethyl-1,3-dioxolane
TL;DR: 2-(4-Bromobutyl)-2-ethyl-1,3-dioxolane (CAS 34956-86-0) is a chemical compound with molecular formula C9H17BrO2 and molecular weight 236.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-bromobutyl)-2-ethyl-1,3-dioxolane
Also Known As: 2-(4-bromobutyl)-2-ethyl-1,3-dioxolane, J1.960.782H, RefChem:251958
| Molecular Formula | C9H17BrO2 |
|---|---|
| Molecular Weight | 236.04 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 236.04118 |
| Heavy Atoms | 12 |
| Complexity | 122.0 |
Chemical Identifiers
| CAS Number | 34956-86-0 |
|---|---|
| SMILES | CCC1(OCCO1)CCCCBr |
| InChIKey | LRWZGRTVZQCKLQ-UHFFFAOYSA-N |
Product Overview
2-(4-Bromobutyl)-2-ethyl-1,3-dioxolane (CAS 34956-86-0), with molecular formula C9H17BrO2 and molecular weight 236.04 g/mol. IUPAC: 2-(4-bromobutyl)-2-ethyl-1,3-dioxolane.
Chemical Property Profile of 2-(4-Bromobutyl)-2-ethyl-1,3-dioxolane
Property Insights of 2-(4-Bromobutyl)-2-ethyl-1,3-dioxolane
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Bromobutyl)-2-ethyl-1,3-dioxolane. With a topological polar surface area (TPSA) of 18.5 Ų, 2-(4-Bromobutyl)-2-ethyl-1,3-dioxolane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Bromobutyl)-2-ethyl-1,3-dioxolane 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-(4-Bromobutyl)-2-ethyl-1,3-dioxolane?
The CAS number of 2-(4-Bromobutyl)-2-ethyl-1,3-dioxolane is 34956-86-0.
What is the molecular formula of 2-(4-Bromobutyl)-2-ethyl-1,3-dioxolane?
The molecular formula of 2-(4-Bromobutyl)-2-ethyl-1,3-dioxolane is C9H17BrO2.
What is the molecular weight of 2-(4-Bromobutyl)-2-ethyl-1,3-dioxolane?
The molecular weight of 2-(4-Bromobutyl)-2-ethyl-1,3-dioxolane is 236.04 g/mol.
Where can I buy 2-(4-Bromobutyl)-2-ethyl-1,3-dioxolane?
You can request a quote for 2-(4-Bromobutyl)-2-ethyl-1,3-dioxolane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Bromobutyl)-2-ethyl-1,3-dioxolane?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Bromobutyl)-2-ethyl-1,3-dioxolane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.