2-Naphthalenesulfonic acid, 8-hydroxy-5,7-dinitro-, aluminum salt (3:2) structure

2-Naphthalenesulfonic acid, 8-hydroxy-5,7-dinitro-, aluminum salt (3:2)

TL;DR: 2-Naphthalenesulfonic acid, 8-hydroxy-5,7-dinitro-, aluminum salt (3:2) (CAS 68698-86-2) is a chemical compound with molecular formula C30H12Al2N6O24S3 and molecular weight 989.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

dialuminum;tris(5,7-dinitro-8-oxidonaphthalene-2-sulfonate)

Also Known As: C10H6N2O8S.2/3Al, Ext. D & C yellow no. 7 aluminum lake, Ext D and C Yellow No. 7, aluminum lake, C10-H6-N2-O8-S.2/3Al, 2-Naphthalenesulfonic acid, 8-hydroxy-5,7-dinitro-, aluminum salt (3:2)

CAS: 68698-86-2
Molecular Formula C30H12Al2N6O24S3
Molecular Weight 989.87 g/mol
LogP 1.14
Topological Polar Surface Area 541.0 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 24
Rotatable Bonds 0
Exact Mass 989.86957
Heavy Atoms 65
Complexity 519.0

Chemical Identifiers

CAS Number 68698-86-2
SMILES C1=CC2=C(C=C1S(=O)(=O)[O-])C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[O-].C1=CC2=C(C=C1S(=O)(=O)[O-])C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[O-].C1=CC2=C(C=C1S(=O)(=O)[O-])C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[O-].[Al+3].[Al+3]
InChIKey DBVXUKIBGLKJBR-UHFFFAOYSA-H

Product Overview

2-Naphthalenesulfonic acid, 8-hydroxy-5,7-dinitro-, aluminum salt (3:2) (CAS 68698-86-2), with molecular formula C30H12Al2N6O24S3 and molecular weight 989.87 g/mol. IUPAC: dialuminum;tris(5,7-dinitro-8-oxidonaphthalene-2-sulfonate).

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of 2-Naphthalenesulfonic acid, 8-hydroxy-5,7-dinitro-, aluminum salt (3:2)

XLogP
1.14
TPSA (Topological Polar Surface Area)
541.0
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
24
Rotatable Bonds
0
Heavy Atoms
65
Complexity
519.0
Exact Mass
989.86957
Monoisotopic Mass
989.86957
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2-Naphthalenesulfonic acid, 8-hydroxy-5,7-dinitro-, aluminum salt (3:2)

The XLogP value of 1.14 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Naphthalenesulfonic acid, 8-hydroxy-5,7-dinitro-, aluminum salt (3:2). The TPSA of 541.0 Ų indicates high polarity, suggesting 2-Naphthalenesulfonic acid, 8-hydroxy-5,7-dinitro-, aluminum salt (3:2) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-Naphthalenesulfonic acid, 8-hydroxy-5,7-dinitro-, aluminum salt (3:2) has 0 hydrogen bond donor(s) and 24 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
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Frequently Asked Questions

What is the CAS number of 2-Naphthalenesulfonic acid, 8-hydroxy-5,7-dinitro-, aluminum salt (3:2)?

The CAS number of 2-Naphthalenesulfonic acid, 8-hydroxy-5,7-dinitro-, aluminum salt (3:2) is 68698-86-2.

What is the molecular formula of 2-Naphthalenesulfonic acid, 8-hydroxy-5,7-dinitro-, aluminum salt (3:2)?

The molecular formula of 2-Naphthalenesulfonic acid, 8-hydroxy-5,7-dinitro-, aluminum salt (3:2) is C30H12Al2N6O24S3.

What is the molecular weight of 2-Naphthalenesulfonic acid, 8-hydroxy-5,7-dinitro-, aluminum salt (3:2)?

The molecular weight of 2-Naphthalenesulfonic acid, 8-hydroxy-5,7-dinitro-, aluminum salt (3:2) is 989.87 g/mol.

Where can I buy 2-Naphthalenesulfonic acid, 8-hydroxy-5,7-dinitro-, aluminum salt (3:2)?

You can request a quote for 2-Naphthalenesulfonic acid, 8-hydroxy-5,7-dinitro-, aluminum salt (3:2) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for 2-Naphthalenesulfonic acid, 8-hydroxy-5,7-dinitro-, aluminum salt (3:2)?

Yes, KEHONG BIO provides custom synthesis services for 2-Naphthalenesulfonic acid, 8-hydroxy-5,7-dinitro-, aluminum salt (3:2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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