Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, nitro-
TL;DR: Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, nitro- (CAS 66085-76-5) is a chemical compound with molecular formula C34H15NO4 and molecular weight 501.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-nitrononacyclo[18.10.2.22,5.03,16.04,13.06,11.017,31.022,27.028,32]tetratriaconta-1(31),2,4,6(11),7,9,13,15,17,19,22,24,26,28(32),29,33-hexadecaene-12,21-dione
Also Known As: Violanthrone, nitro-, Nitroviolanthrene-5,10-dione, 2-nitroanthra[9,1,2-cde]benzo[rst]pentaphene-5,10-dione, Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, nitro-, Anthra[9,1,2-cde]benzo[rst]pentaphene-5,10-dione, nitro-
| Molecular Formula | C34H15NO4 |
|---|---|
| Molecular Weight | 501.10 g/mol |
| LogP | 7.9 |
| Topological Polar Surface Area | 80.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 501.1001 |
| Heavy Atoms | 39 |
| Complexity | 1080.0 |
Chemical Identifiers
| CAS Number | 66085-76-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=C4C(=CC=C5C4=C(C=C3)C6=C7C5=CC=C8C7=C(C=C6)C9=C(C8=O)C=CC(=C9)[N+](=O)[O-])C2=O |
| InChIKey | JMLRQFUKQHMMLV-UHFFFAOYSA-N |
Product Overview
Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, nitro- (CAS 66085-76-5), with molecular formula C34H15NO4 and molecular weight 501.10 g/mol. IUPAC: 8-nitrononacyclo[18.10.2.22,5.03,16.04,13.06,11.017,31.022,27.028,32]tetratriaconta-1(31),2,4,6(11),7,9,13,15,17,19,22,24,26,28(32),29,33-hexadecaene-12,21-dione.
Chemical Property Profile of Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, nitro-
Property Insights of Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, nitro-
The XLogP value of 7.9 indicates that Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, nitro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, nitro-. Following Lipinski's Rule of Five, Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, nitro- has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, nitro-?
The CAS number of Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, nitro- is 66085-76-5.
What is the molecular formula of Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, nitro-?
The molecular formula of Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, nitro- is C34H15NO4.
What is the molecular weight of Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, nitro-?
The molecular weight of Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, nitro- is 501.10 g/mol.
Where can I buy Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, nitro-?
You can request a quote for Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, nitro-?
Yes, KEHONG BIO provides custom synthesis services for Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.