4-Chloro-1,5-dinitronaphthalene
TL;DR: 4-Chloro-1,5-dinitronaphthalene (CAS 38025-49-9) is a chemical compound with molecular formula C10H5ClN2O4 and molecular weight 251.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-1,5-dinitronaphthalene
Also Known As: 4-Chloro-1,5-dinitronaphthalene, Naphthalene,5-dinitro-, Naphthalene, 4-chloro-1,5-dinitro-, 1-chloro-4,8-dinitronaphthalene, 4-chloro-1,5-dinitro-naphthalene
| Molecular Formula | C10H5ClN2O4 |
|---|---|
| Molecular Weight | 251.99 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 91.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 251.99379 |
| Heavy Atoms | 17 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 38025-49-9 |
|---|---|
| SMILES | C1=CC2=C(C=CC(=C2C(=C1)[N+](=O)[O-])Cl)[N+](=O)[O-] |
| InChIKey | KCMPORJIBRHUHC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Chloro-1,5-dinitronaphthalene (CAS 38025-49-9), with molecular formula C10H5ClN2O4 and molecular weight 251.99 g/mol. IUPAC: 4-chloro-1,5-dinitronaphthalene.
Chemical Property Profile of 4-Chloro-1,5-dinitronaphthalene
Property Insights of 4-Chloro-1,5-dinitronaphthalene
The XLogP value of 3.2 indicates that 4-Chloro-1,5-dinitronaphthalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chloro-1,5-dinitronaphthalene. Following Lipinski's Rule of Five, 4-Chloro-1,5-dinitronaphthalene 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 4-Chloro-1,5-dinitronaphthalene?
The CAS number of 4-Chloro-1,5-dinitronaphthalene is 38025-49-9.
What is the molecular formula of 4-Chloro-1,5-dinitronaphthalene?
The molecular formula of 4-Chloro-1,5-dinitronaphthalene is C10H5ClN2O4.
What is the molecular weight of 4-Chloro-1,5-dinitronaphthalene?
The molecular weight of 4-Chloro-1,5-dinitronaphthalene is 251.99 g/mol.
Where can I buy 4-Chloro-1,5-dinitronaphthalene?
You can request a quote for 4-Chloro-1,5-dinitronaphthalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-1,5-dinitronaphthalene?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-1,5-dinitronaphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.