9-Nitroanthracene
TL;DR: 9-Nitroanthracene (CAS 602-60-8) 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.
9-nitroanthracene
Also Known As: 9-NITROANTHRACENE, Anthracene, 9-nitro-, 5-Nitroanthracene, 9-Nitro-anthracene, 9-Nitroanthracene, 93%
| Molecular Formula | C14H9NO2 |
|---|---|
| Molecular Weight | 223.06 g/mol |
| LogP | 4.8 |
| 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 | 277.0 |
| Melting Point | 286 to 142.8 °C |
| Boiling Point | 275.0 °C at 17 mmHg |
| Solubility | less than 0.1 mg/mL at 64 °F (NTP, 1992) |
| Vapor Pressure | 0.00000135 [mmHg] |
Chemical Identifiers
| CAS Number | 602-60-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C3C=CC=CC3=C2[N+](=O)[O-] |
| InChIKey | LSIKFJXEYJIZNB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
9-Nitroanthracene (CAS 602-60-8), with molecular formula C14H9NO2 and molecular weight 223.06 g/mol. IUPAC: 9-nitroanthracene.
Chemical Property Profile of 9-Nitroanthracene
Property Insights of 9-Nitroanthracene
The XLogP value of 4.8 indicates that 9-Nitroanthracene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, 9-Nitroanthracene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-Nitroanthracene 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 9-Nitroanthracene?
The CAS number of 9-Nitroanthracene is 602-60-8.
What is the molecular formula of 9-Nitroanthracene?
The molecular formula of 9-Nitroanthracene is C14H9NO2.
What is the molecular weight of 9-Nitroanthracene?
The molecular weight of 9-Nitroanthracene is 223.06 g/mol.
Where can I buy 9-Nitroanthracene?
You can request a quote for 9-Nitroanthracene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Nitroanthracene?
Yes, KEHONG BIO provides custom synthesis services for 9-Nitroanthracene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.