Benzo(ghi)perylene, 2-nitro-
TL;DR: Benzo(ghi)perylene, 2-nitro- (CAS 91259-17-5) is a chemical compound with molecular formula C22H11NO2 and molecular weight 321.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-nitrohexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17(22),18,20-undecaene
Also Known As: 1-Nitrobenzo[ghi]perylene, 1-Nitrobenzo(ghi)perylene, Benzo(ghi)perylene, 2-nitro-, Benzene,1-chloro-4-[[4-(1-methylethyl)phenoxy]methyl], 12-nitrohexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(22),2,4,6,8,10,12,14,16,18,20-undecaene
| Molecular Formula | C22H11NO2 |
|---|---|
| Molecular Weight | 321.08 g/mol |
| LogP | 6.7 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 321.07898 |
| Heavy Atoms | 25 |
| Complexity | 571.0 |
Chemical Identifiers
| CAS Number | 91259-17-5 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)C4=CC=CC5=C4C6=C3C(=CC(=C6C=C5)[N+](=O)[O-])C=C2 |
| InChIKey | KULHMGZTJCYHIF-UHFFFAOYSA-N |
Product Overview
Benzo(ghi)perylene, 2-nitro- (CAS 91259-17-5), with molecular formula C22H11NO2 and molecular weight 321.08 g/mol. IUPAC: 7-nitrohexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17(22),18,20-undecaene.
Chemical Property Profile of Benzo(ghi)perylene, 2-nitro-
Property Insights of Benzo(ghi)perylene, 2-nitro-
The XLogP value of 6.7 indicates that Benzo(ghi)perylene, 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, Benzo(ghi)perylene, 2-nitro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo(ghi)perylene, 2-nitro- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzo(ghi)perylene, 2-nitro-?
The CAS number of Benzo(ghi)perylene, 2-nitro- is 91259-17-5.
What is the molecular formula of Benzo(ghi)perylene, 2-nitro-?
The molecular formula of Benzo(ghi)perylene, 2-nitro- is C22H11NO2.
What is the molecular weight of Benzo(ghi)perylene, 2-nitro-?
The molecular weight of Benzo(ghi)perylene, 2-nitro- is 321.08 g/mol.
Where can I buy Benzo(ghi)perylene, 2-nitro-?
You can request a quote for Benzo(ghi)perylene, 2-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzo(ghi)perylene, 2-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Benzo(ghi)perylene, 2-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.