2,9-Dimethyl-5-nitro-1,10-phenanthroline
TL;DR: 2,9-Dimethyl-5-nitro-1,10-phenanthroline (CAS 118752-27-5) is a chemical compound with molecular formula C14H11N3O2 and molecular weight 253.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,9-dimethyl-5-nitro-1,10-phenanthroline
Also Known As: 2,9-dimethyl-5-nitro-1,10-phenanthroline, 5-Nitro-2,10-Phenanthroline, 5-nitro-2,9-dimethylphenanthroline, 1,10-Phenanthroline, 2,9-dimethyl-5-nitro-, 5-Nitro-2,9-Dimethyl-1,10-Phenanthroline
| Molecular Formula | C14H11N3O2 |
|---|---|
| Molecular Weight | 253.09 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 71.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 253.08513 |
| Heavy Atoms | 19 |
| Complexity | 357.0 |
Chemical Identifiers
| CAS Number | 118752-27-5 |
|---|---|
| SMILES | CC1=NC2=C3C(=C(C=C2C=C1)[N+](=O)[O-])C=CC(=N3)C |
| InChIKey | ZZKNDQYPXPYVNS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,9-Dimethyl-5-nitro-1,10-phenanthroline (CAS 118752-27-5), with molecular formula C14H11N3O2 and molecular weight 253.09 g/mol. IUPAC: 2,9-dimethyl-5-nitro-1,10-phenanthroline.
Chemical Property Profile of 2,9-Dimethyl-5-nitro-1,10-phenanthroline
Property Insights of 2,9-Dimethyl-5-nitro-1,10-phenanthroline
The XLogP value of 3.1 indicates that 2,9-Dimethyl-5-nitro-1,10-phenanthroline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,9-Dimethyl-5-nitro-1,10-phenanthroline. Following Lipinski's Rule of Five, 2,9-Dimethyl-5-nitro-1,10-phenanthroline 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 2,9-Dimethyl-5-nitro-1,10-phenanthroline?
The CAS number of 2,9-Dimethyl-5-nitro-1,10-phenanthroline is 118752-27-5.
What is the molecular formula of 2,9-Dimethyl-5-nitro-1,10-phenanthroline?
The molecular formula of 2,9-Dimethyl-5-nitro-1,10-phenanthroline is C14H11N3O2.
What is the molecular weight of 2,9-Dimethyl-5-nitro-1,10-phenanthroline?
The molecular weight of 2,9-Dimethyl-5-nitro-1,10-phenanthroline is 253.09 g/mol.
Where can I buy 2,9-Dimethyl-5-nitro-1,10-phenanthroline?
You can request a quote for 2,9-Dimethyl-5-nitro-1,10-phenanthroline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,9-Dimethyl-5-nitro-1,10-phenanthroline?
Yes, KEHONG BIO provides custom synthesis services for 2,9-Dimethyl-5-nitro-1,10-phenanthroline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.