2-(3-Nitrophenyl)-1,3-dioxolane
TL;DR: 2-(3-Nitrophenyl)-1,3-dioxolane (CAS 86358-28-3) is a chemical compound with molecular formula C9H9NO4 and molecular weight 195.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-nitrophenyl)-1,3-dioxolane
Also Known As: 2-(3-nitrophenyl)-1,3-dioxolane, 3-Nitrobenzaldehyde ethylene acetal, 1, 2-(m-nitrophenyl)-, 1, 2-(3-nitrophenyl)-, 3-nitrophenyl-1,3-dioxolane
| Molecular Formula | C9H9NO4 |
|---|---|
| Molecular Weight | 195.05 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 64.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 195.05316 |
| Heavy Atoms | 14 |
| Complexity | 209.0 |
Chemical Identifiers
| CAS Number | 86358-28-3 |
|---|---|
| SMILES | C1COC(O1)C2=CC(=CC=C2)[N+](=O)[O-] |
| InChIKey | YOGPCAYIEHLIMG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(3-Nitrophenyl)-1,3-dioxolane (CAS 86358-28-3), with molecular formula C9H9NO4 and molecular weight 195.05 g/mol. IUPAC: 2-(3-nitrophenyl)-1,3-dioxolane.
Chemical Property Profile of 2-(3-Nitrophenyl)-1,3-dioxolane
Property Insights of 2-(3-Nitrophenyl)-1,3-dioxolane
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Nitrophenyl)-1,3-dioxolane. The TPSA of 64.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Nitrophenyl)-1,3-dioxolane. Following Lipinski's Rule of Five, 2-(3-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-(3-Nitrophenyl)-1,3-dioxolane?
The CAS number of 2-(3-Nitrophenyl)-1,3-dioxolane is 86358-28-3.
What is the molecular formula of 2-(3-Nitrophenyl)-1,3-dioxolane?
The molecular formula of 2-(3-Nitrophenyl)-1,3-dioxolane is C9H9NO4.
What is the molecular weight of 2-(3-Nitrophenyl)-1,3-dioxolane?
The molecular weight of 2-(3-Nitrophenyl)-1,3-dioxolane is 195.05 g/mol.
Where can I buy 2-(3-Nitrophenyl)-1,3-dioxolane?
You can request a quote for 2-(3-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-(3-Nitrophenyl)-1,3-dioxolane?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Nitrophenyl)-1,3-dioxolane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.