3-(5-Bromo-5-nitro-1,3-dioxan-2-yl)phenol
TL;DR: 3-(5-Bromo-5-nitro-1,3-dioxan-2-yl)phenol (CAS 60766-60-1) is a chemical compound with molecular formula C10H10BrNO5 and molecular weight 302.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5-bromo-5-nitro-1,3-dioxan-2-yl)phenol
Also Known As: 3-(5-bromo-5-nitro-1,3-dioxan-2-yl)phenol
| Molecular Formula | C10H10BrNO5 |
|---|---|
| Molecular Weight | 302.97 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 302.97424 |
| Heavy Atoms | 17 |
| Complexity | 287.0 |
Chemical Identifiers
| CAS Number | 60766-60-1 |
|---|---|
| SMILES | C1C(COC(O1)C2=CC(=CC=C2)O)([N+](=O)[O-])Br |
| InChIKey | JKINAYVYKTUUCF-UHFFFAOYSA-N |
Product Overview
3-(5-Bromo-5-nitro-1,3-dioxan-2-yl)phenol (CAS 60766-60-1), with molecular formula C10H10BrNO5 and molecular weight 302.97 g/mol. IUPAC: 3-(5-bromo-5-nitro-1,3-dioxan-2-yl)phenol.
Chemical Property Profile of 3-(5-Bromo-5-nitro-1,3-dioxan-2-yl)phenol
Property Insights of 3-(5-Bromo-5-nitro-1,3-dioxan-2-yl)phenol
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(5-Bromo-5-nitro-1,3-dioxan-2-yl)phenol. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(5-Bromo-5-nitro-1,3-dioxan-2-yl)phenol. Following Lipinski's Rule of Five, 3-(5-Bromo-5-nitro-1,3-dioxan-2-yl)phenol has 1 hydrogen bond donor(s) and 5 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 3-(5-Bromo-5-nitro-1,3-dioxan-2-yl)phenol?
The CAS number of 3-(5-Bromo-5-nitro-1,3-dioxan-2-yl)phenol is 60766-60-1.
What is the molecular formula of 3-(5-Bromo-5-nitro-1,3-dioxan-2-yl)phenol?
The molecular formula of 3-(5-Bromo-5-nitro-1,3-dioxan-2-yl)phenol is C10H10BrNO5.
What is the molecular weight of 3-(5-Bromo-5-nitro-1,3-dioxan-2-yl)phenol?
The molecular weight of 3-(5-Bromo-5-nitro-1,3-dioxan-2-yl)phenol is 302.97 g/mol.
Where can I buy 3-(5-Bromo-5-nitro-1,3-dioxan-2-yl)phenol?
You can request a quote for 3-(5-Bromo-5-nitro-1,3-dioxan-2-yl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(5-Bromo-5-nitro-1,3-dioxan-2-yl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 3-(5-Bromo-5-nitro-1,3-dioxan-2-yl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.