4-Bromo-3,5,5-trimethyl-1,2-dioxolan-3-ol
TL;DR: 4-Bromo-3,5,5-trimethyl-1,2-dioxolan-3-ol (CAS 75332-39-7) is a chemical compound with molecular formula C6H11BrO3 and molecular weight 209.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-3,5,5-trimethyldioxolan-3-ol
Also Known As: 4-bromo-3,5,5-trimethyldioxolan-3-ol, 1, 4-bromo-3,5,5-trimethyl-, 4-Bromo-3,5,5-trimethyl-1,2-dioxolan-3-ol, 1,2-Dioxolan-3-ol, 4-bromo-3,5,5-trimethyl-, RefChem:290792
| Molecular Formula | C6H11BrO3 |
|---|---|
| Molecular Weight | 209.99 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 209.98917 |
| Heavy Atoms | 10 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 75332-39-7 |
|---|---|
| SMILES | CC1(C(C(OO1)(C)O)Br)C |
| InChIKey | FJUSKNXKNCWUDG-UHFFFAOYSA-N |
Product Overview
4-Bromo-3,5,5-trimethyl-1,2-dioxolan-3-ol (CAS 75332-39-7), with molecular formula C6H11BrO3 and molecular weight 209.99 g/mol. IUPAC: 4-bromo-3,5,5-trimethyldioxolan-3-ol.
Chemical Property Profile of 4-Bromo-3,5,5-trimethyl-1,2-dioxolan-3-ol
Property Insights of 4-Bromo-3,5,5-trimethyl-1,2-dioxolan-3-ol
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromo-3,5,5-trimethyl-1,2-dioxolan-3-ol. With a topological polar surface area (TPSA) of 38.7 Ų, 4-Bromo-3,5,5-trimethyl-1,2-dioxolan-3-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-3,5,5-trimethyl-1,2-dioxolan-3-ol has 1 hydrogen bond donor(s) and 3 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 4-Bromo-3,5,5-trimethyl-1,2-dioxolan-3-ol?
The CAS number of 4-Bromo-3,5,5-trimethyl-1,2-dioxolan-3-ol is 75332-39-7.
What is the molecular formula of 4-Bromo-3,5,5-trimethyl-1,2-dioxolan-3-ol?
The molecular formula of 4-Bromo-3,5,5-trimethyl-1,2-dioxolan-3-ol is C6H11BrO3.
What is the molecular weight of 4-Bromo-3,5,5-trimethyl-1,2-dioxolan-3-ol?
The molecular weight of 4-Bromo-3,5,5-trimethyl-1,2-dioxolan-3-ol is 209.99 g/mol.
Where can I buy 4-Bromo-3,5,5-trimethyl-1,2-dioxolan-3-ol?
You can request a quote for 4-Bromo-3,5,5-trimethyl-1,2-dioxolan-3-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-3,5,5-trimethyl-1,2-dioxolan-3-ol?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-3,5,5-trimethyl-1,2-dioxolan-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.