Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, 15,18-dinitro-
TL;DR: Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, 15,18-dinitro- (CAS 67446-03-1) is a chemical compound with molecular formula C34H14N2O6 and molecular weight 546.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
29,33-dinitrononacyclo[18.10.2.22,5.03,16.04,13.06,11.017,31.022,27.028,32]tetratriaconta-1(30),2(34),3(16),4(13),5(33),6,8,10,14,17(31),18,20(32),22,24,26,28-hexadecaene-12,21-dione
Also Known As: Vat Black K, Vat Black S, ANTHRA(9,1,2-cde)BENZO(rst)PENTAPHENE-5,10-DIONE, 15,18-DINITRO-, 15,18-Dinitroanthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, 15,18-Dinitroanthra[9,1,2-cde]benzo[rst]pentaphene-5,10-dione
| Molecular Formula | C34H14N2O6 |
|---|---|
| Molecular Weight | 546.09 g/mol |
| LogP | 7.7 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 546.0852 |
| Heavy Atoms | 42 |
| Complexity | 1120.0 |
Chemical Identifiers
| CAS Number | 67446-03-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=C(C=C4C5=CC(=C6C7=CC=CC=C7C(=O)C8=C6C5=C(C=C8)C9=C4C3=C(C2=O)C=C9)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | PFCKWBBXWHDJRJ-UHFFFAOYSA-N |
Product Overview
Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, 15,18-dinitro- (CAS 67446-03-1), with molecular formula C34H14N2O6 and molecular weight 546.09 g/mol. IUPAC: 29,33-dinitrononacyclo[18.10.2.22,5.03,16.04,13.06,11.017,31.022,27.028,32]tetratriaconta-1(30),2(34),3(16),4(13),5(33),6,8,10,14,17(31),18,20(32),22,24,26,28-hexadecaene-12,21-dione.
Chemical Property Profile of Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, 15,18-dinitro-
Property Insights of Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, 15,18-dinitro-
The XLogP value of 7.7 indicates that Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, 15,18-dinitro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, 15,18-dinitro-. Following Lipinski's Rule of Five, Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, 15,18-dinitro- has 0 hydrogen bond donor(s) and 6 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, 15,18-dinitro-?
The CAS number of Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, 15,18-dinitro- is 67446-03-1.
What is the molecular formula of Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, 15,18-dinitro-?
The molecular formula of Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, 15,18-dinitro- is C34H14N2O6.
What is the molecular weight of Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, 15,18-dinitro-?
The molecular weight of Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, 15,18-dinitro- is 546.09 g/mol.
Where can I buy Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, 15,18-dinitro-?
You can request a quote for Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, 15,18-dinitro- 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, 15,18-dinitro-?
Yes, KEHONG BIO provides custom synthesis services for Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, 15,18-dinitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.