BENZO(ghi)PERYLENE, 5-NITRO-
TL;DR: BENZO(ghi)PERYLENE, 5-NITRO- (CAS 81316-87-2) 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.
2-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: 5-Nitrobenzo(ghi)perylene, 5-nitrobenzo[ghi]perylene, BENZO(ghi)PERYLENE, 5-NITRO-, 5-NITROBENZO PERYLENE, 7-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 | 6.9 |
| 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 | 81316-87-2 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)C4=C5C(=C(C=C4)[N+](=O)[O-])C=CC6=C5C3=C(C=C2)C=C6 |
| InChIKey | PEVCOODQXOIYQH-UHFFFAOYSA-N |
Product Overview
BENZO(ghi)PERYLENE, 5-NITRO- (CAS 81316-87-2), with molecular formula C22H11NO2 and molecular weight 321.08 g/mol. IUPAC: 2-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, 5-NITRO-
Property Insights of BENZO(ghi)PERYLENE, 5-NITRO-
The XLogP value of 6.9 indicates that BENZO(ghi)PERYLENE, 5-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, 5-NITRO- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BENZO(ghi)PERYLENE, 5-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, 5-NITRO-?
The CAS number of BENZO(ghi)PERYLENE, 5-NITRO- is 81316-87-2.
What is the molecular formula of BENZO(ghi)PERYLENE, 5-NITRO-?
The molecular formula of BENZO(ghi)PERYLENE, 5-NITRO- is C22H11NO2.
What is the molecular weight of BENZO(ghi)PERYLENE, 5-NITRO-?
The molecular weight of BENZO(ghi)PERYLENE, 5-NITRO- is 321.08 g/mol.
Where can I buy BENZO(ghi)PERYLENE, 5-NITRO-?
You can request a quote for BENZO(ghi)PERYLENE, 5-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, 5-NITRO-?
Yes, KEHONG BIO provides custom synthesis services for BENZO(ghi)PERYLENE, 5-NITRO- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.