Naphthalene, 1,3,8-trinitro-
TL;DR: Naphthalene, 1,3,8-trinitro- (CAS 2364-46-7) is a chemical compound with molecular formula C10H5N3O6 and molecular weight 263.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,8-trinitronaphthalene
Also Known As: 1,3,8-Trinitronaphthalene, Naphthalene, 1,3,8-trinitro-, 1,3,8-Trinitronaphthalen, 1,3,8-Trinitronaphthalin, Naphthalene,1,3,8-trinitro-
| Molecular Formula | C10H5N3O6 |
|---|---|
| Molecular Weight | 263.02 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 137.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 263.01782 |
| Heavy Atoms | 19 |
| Complexity | 398.0 |
Chemical Identifiers
| CAS Number | 2364-46-7 |
|---|---|
| SMILES | C1=CC2=CC(=CC(=C2C(=C1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | BEKZHETVNVFYCV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Naphthalene, 1,3,8-trinitro- (CAS 2364-46-7), with molecular formula C10H5N3O6 and molecular weight 263.02 g/mol. IUPAC: 1,3,8-trinitronaphthalene.
Chemical Property Profile of Naphthalene, 1,3,8-trinitro-
Property Insights of Naphthalene, 1,3,8-trinitro-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Naphthalene, 1,3,8-trinitro-. The TPSA of 137.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Naphthalene, 1,3,8-trinitro-. Following Lipinski's Rule of Five, Naphthalene, 1,3,8-trinitro- has 0 hydrogen bond donor(s) and 6 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, 1,3,8-trinitro-?
The CAS number of Naphthalene, 1,3,8-trinitro- is 2364-46-7.
What is the molecular formula of Naphthalene, 1,3,8-trinitro-?
The molecular formula of Naphthalene, 1,3,8-trinitro- is C10H5N3O6.
What is the molecular weight of Naphthalene, 1,3,8-trinitro-?
The molecular weight of Naphthalene, 1,3,8-trinitro- is 263.02 g/mol.
Where can I buy Naphthalene, 1,3,8-trinitro-?
You can request a quote for Naphthalene, 1,3,8-trinitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Naphthalene, 1,3,8-trinitro-?
Yes, KEHONG BIO provides custom synthesis services for Naphthalene, 1,3,8-trinitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.