Triphenylene, 2-nitro-
TL;DR: Triphenylene, 2-nitro- (CAS 81316-79-2) is a chemical compound with molecular formula C18H11NO2 and molecular weight 273.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-nitrotriphenylene
Also Known As: 2-nitrotriphenylene, Triphenylene, 2-nitro-, 6-Nitrotriphenylene, J1.191.591D, RefChem:386542
| Molecular Formula | C18H11NO2 |
|---|---|
| Molecular Weight | 273.08 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 273.07898 |
| Heavy Atoms | 21 |
| Complexity | 405.0 |
Chemical Identifiers
| CAS Number | 81316-79-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=C(C=C(C=C3)[N+](=O)[O-])C4=CC=CC=C24 |
| InChIKey | WFWCWFPGYUDATP-UHFFFAOYSA-N |
Product Overview
Triphenylene, 2-nitro- (CAS 81316-79-2), with molecular formula C18H11NO2 and molecular weight 273.08 g/mol. IUPAC: 2-nitrotriphenylene.
Chemical Property Profile of Triphenylene, 2-nitro-
Property Insights of Triphenylene, 2-nitro-
The XLogP value of 4.7 indicates that Triphenylene, 2-nitro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, Triphenylene, 2-nitro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Triphenylene, 2-nitro- 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 Triphenylene, 2-nitro-?
The CAS number of Triphenylene, 2-nitro- is 81316-79-2.
What is the molecular formula of Triphenylene, 2-nitro-?
The molecular formula of Triphenylene, 2-nitro- is C18H11NO2.
What is the molecular weight of Triphenylene, 2-nitro-?
The molecular weight of Triphenylene, 2-nitro- is 273.08 g/mol.
Where can I buy Triphenylene, 2-nitro-?
You can request a quote for Triphenylene, 2-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Triphenylene, 2-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Triphenylene, 2-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.