Naphthalene, 1,4,5,8-tetranitro-
TL;DR: Naphthalene, 1,4,5,8-tetranitro- (CAS 4793-98-0) is a chemical compound with molecular formula C10H4N4O8 and molecular weight 308.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4,5,8-tetranitronaphthalene
Also Known As: 1,4,5,8-Tetranitronaphthalene, Naphthalene, 1,4,5,8-tetranitro-, 1,5,8-Tetranitronaphthalene, Naphthalene,4,5,8-tetranitro-, 1,4,5, 8-Tetranitronaphthalene
| Molecular Formula | C10H4N4O8 |
|---|---|
| Molecular Weight | 308.00 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 183.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 0 |
| Exact Mass | 308.0029 |
| Heavy Atoms | 22 |
| Complexity | 413.0 |
Chemical Identifiers
| CAS Number | 4793-98-0 |
|---|---|
| SMILES | C1=CC(=C2C(=CC=C(C2=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | YOYJZNWSWVZEKY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Naphthalene, 1,4,5,8-tetranitro- (CAS 4793-98-0), with molecular formula C10H4N4O8 and molecular weight 308.00 g/mol. IUPAC: 1,4,5,8-tetranitronaphthalene.
Chemical Property Profile of Naphthalene, 1,4,5,8-tetranitro-
Property Insights of Naphthalene, 1,4,5,8-tetranitro-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Naphthalene, 1,4,5,8-tetranitro-. The TPSA of 183.0 Ų indicates high polarity, suggesting Naphthalene, 1,4,5,8-tetranitro- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Naphthalene, 1,4,5,8-tetranitro- has 0 hydrogen bond donor(s) and 8 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 Naphthalene, 1,4,5,8-tetranitro-?
The CAS number of Naphthalene, 1,4,5,8-tetranitro- is 4793-98-0.
What is the molecular formula of Naphthalene, 1,4,5,8-tetranitro-?
The molecular formula of Naphthalene, 1,4,5,8-tetranitro- is C10H4N4O8.
What is the molecular weight of Naphthalene, 1,4,5,8-tetranitro-?
The molecular weight of Naphthalene, 1,4,5,8-tetranitro- is 308.00 g/mol.
Where can I buy Naphthalene, 1,4,5,8-tetranitro-?
You can request a quote for Naphthalene, 1,4,5,8-tetranitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Naphthalene, 1,4,5,8-tetranitro-?
Yes, KEHONG BIO provides custom synthesis services for Naphthalene, 1,4,5,8-tetranitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.