Phenanthrene, 4-nitro-
TL;DR: Phenanthrene, 4-nitro- (CAS 82064-15-1) is a chemical compound with molecular formula C14H9NO2 and molecular weight 223.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitrophenanthrene
Also Known As: 4-Nitrophenanthrene, Phenanthrene, 4-nitro-, 4-Nitro-phenanthren, RefChem:368554
| Molecular Formula | C14H9NO2 |
|---|---|
| Molecular Weight | 223.06 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 223.06332 |
| Heavy Atoms | 17 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 82064-15-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=C2C(=CC=C3)[N+](=O)[O-] |
| InChIKey | JMKUZZRDJVZRQZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phenanthrene, 4-nitro- (CAS 82064-15-1), with molecular formula C14H9NO2 and molecular weight 223.06 g/mol. IUPAC: 4-nitrophenanthrene.
Chemical Property Profile of Phenanthrene, 4-nitro-
Property Insights of Phenanthrene, 4-nitro-
The XLogP value of 4.4 indicates that Phenanthrene, 4-nitro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, Phenanthrene, 4-nitro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenanthrene, 4-nitro- has 0 hydrogen bond donor(s) and 2 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 Phenanthrene, 4-nitro-?
The CAS number of Phenanthrene, 4-nitro- is 82064-15-1.
What is the molecular formula of Phenanthrene, 4-nitro-?
The molecular formula of Phenanthrene, 4-nitro- is C14H9NO2.
What is the molecular weight of Phenanthrene, 4-nitro-?
The molecular weight of Phenanthrene, 4-nitro- is 223.06 g/mol.
Where can I buy Phenanthrene, 4-nitro-?
You can request a quote for Phenanthrene, 4-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenanthrene, 4-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Phenanthrene, 4-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.