2-(Bromomethyl)-2-(4-nitrophenyl)-1,3-dioxolane
TL;DR: 2-(Bromomethyl)-2-(4-nitrophenyl)-1,3-dioxolane (CAS 3418-28-8) is a chemical compound with molecular formula C10H10BrNO4 and molecular weight 286.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(bromomethyl)-2-(4-nitrophenyl)-1,3-dioxolane
Also Known As: 2-(bromomethyl)-2-(4-nitrophenyl)-1,3-dioxolane, 2- -2- -1,3-dioxolane, J3.468.848F, 1,3-Dioxolane, 2-(bromomethyl)-2-(4-nitrophenyl)-, 2-Brommethyl-2-<4-nitro-phenyl>-<1,3>dioxolan
| Molecular Formula | C10H10BrNO4 |
|---|---|
| Molecular Weight | 286.98 g/mol |
| LogP | 2.1893 |
| Topological Polar Surface Area | 61.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 286.9793 |
| Heavy Atoms | 16 |
| Complexity | 386.31042 |
Chemical Identifiers
| CAS Number | 3418-28-8 |
|---|---|
| SMILES | C1COC(O1)(CBr)C2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
2-(Bromomethyl)-2-(4-nitrophenyl)-1,3-dioxolane (CAS 3418-28-8), with molecular formula C10H10BrNO4 and molecular weight 286.98 g/mol. IUPAC: 2-(bromomethyl)-2-(4-nitrophenyl)-1,3-dioxolane.
Chemical Property Profile of 2-(Bromomethyl)-2-(4-nitrophenyl)-1,3-dioxolane
Property Insights of 2-(Bromomethyl)-2-(4-nitrophenyl)-1,3-dioxolane
The XLogP value of 2.1893 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Bromomethyl)-2-(4-nitrophenyl)-1,3-dioxolane. The TPSA of 61.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Bromomethyl)-2-(4-nitrophenyl)-1,3-dioxolane. Following Lipinski's Rule of Five, 2-(Bromomethyl)-2-(4-nitrophenyl)-1,3-dioxolane has 0 hydrogen bond donor(s) and 4 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-(Bromomethyl)-2-(4-nitrophenyl)-1,3-dioxolane?
The CAS number of 2-(Bromomethyl)-2-(4-nitrophenyl)-1,3-dioxolane is 3418-28-8.
What is the molecular formula of 2-(Bromomethyl)-2-(4-nitrophenyl)-1,3-dioxolane?
The molecular formula of 2-(Bromomethyl)-2-(4-nitrophenyl)-1,3-dioxolane is C10H10BrNO4.
What is the molecular weight of 2-(Bromomethyl)-2-(4-nitrophenyl)-1,3-dioxolane?
The molecular weight of 2-(Bromomethyl)-2-(4-nitrophenyl)-1,3-dioxolane is 286.98 g/mol.
Where can I buy 2-(Bromomethyl)-2-(4-nitrophenyl)-1,3-dioxolane?
You can request a quote for 2-(Bromomethyl)-2-(4-nitrophenyl)-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-(Bromomethyl)-2-(4-nitrophenyl)-1,3-dioxolane?
Yes, KEHONG BIO provides custom synthesis services for 2-(Bromomethyl)-2-(4-nitrophenyl)-1,3-dioxolane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.