1-Nitrophenanthrene
TL;DR: 1-Nitrophenanthrene (CAS 17024-17-8) 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.
1-nitrophenanthrene
Also Known As: 1-Nitrophenanthrene, 1-Nitroperylen, 4-Nitrophenanthrene, Phenanthrene, 1-nitro-, Phenanthrene, nitro-
| 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 | 17024-17-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=C2C=CC=C3[N+](=O)[O-] |
| InChIKey | SGNWFFATVZVHNF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Nitrophenanthrene (CAS 17024-17-8), with molecular formula C14H9NO2 and molecular weight 223.06 g/mol. IUPAC: 1-nitrophenanthrene.
Chemical Property Profile of 1-Nitrophenanthrene
Property Insights of 1-Nitrophenanthrene
The XLogP value of 4.4 indicates that 1-Nitrophenanthrene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, 1-Nitrophenanthrene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Nitrophenanthrene 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 1-Nitrophenanthrene?
The CAS number of 1-Nitrophenanthrene is 17024-17-8.
What is the molecular formula of 1-Nitrophenanthrene?
The molecular formula of 1-Nitrophenanthrene is C14H9NO2.
What is the molecular weight of 1-Nitrophenanthrene?
The molecular weight of 1-Nitrophenanthrene is 223.06 g/mol.
Where can I buy 1-Nitrophenanthrene?
You can request a quote for 1-Nitrophenanthrene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Nitrophenanthrene?
Yes, KEHONG BIO provides custom synthesis services for 1-Nitrophenanthrene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.