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Sodium chromotropate structure
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Sodium chromotropate

TL;DR: Sodium chromotropate (CAS 129-96-4) is a chemical compound with molecular formula C10H6Na2O8S2 and molecular weight 363.92996 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

disodium;4,5-dihydroxynaphthalene-2,7-disulfonate

Also Known As: Sodium chromotropate, Chromotropic acid disodium salt, Disodium chromotropate, mordantbrown, Mordant Brown 7

CAS Number
129-96-4
Molecular Formula
C10H6Na2O8S2
Molecular Weight
363.92996 g/mol
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Application Areas

Top 5 of 13 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (4 patents) Analytical Reagents (11 patents) Catalysts (2 patents) Coatings & Adhesives (8 patents) Heterocyclic Building Blocks (17 patents)

Technical Specifications

Molecular FormulaC10H6Na2O8S2
Molecular Weight363.92996 g/mol
XLogP-5.93
Topological Polar Surface Area (TPSA)172.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors8
Rotatable Bonds0
Exact Mass363.92996 Da
Heavy Atoms22
Complexity480.0
SMILESC1=C2C=C(C=C(C2=C(C=C1S(=O)(=O)[O-])O)O)S(=O)(=O)[O-].[Na+].[Na+]
InChIKeyAFGPCIMUGMJQPD-UHFFFAOYSA-L

Chemical Property Profile of Sodium chromotropate

XLogP
-5.93
TPSA (Topological Polar Surface Area)
172.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
8
Rotatable Bonds
0
Heavy Atoms
22
Complexity
480.0
Exact Mass
363.92996
Monoisotopic Mass
363.92996
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 Sodium chromotropate

The XLogP value of -5.93 indicates that Sodium chromotropate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 172.0 Ų indicates high polarity, suggesting Sodium chromotropate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Sodium chromotropate has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Sodium chromotropate?

The CAS number of Sodium chromotropate is 129-96-4.

What is the molecular formula of Sodium chromotropate?

The molecular formula of Sodium chromotropate is C10H6Na2O8S2.

What is the molecular weight of Sodium chromotropate?

The molecular weight of Sodium chromotropate is 363.92996 g/mol.

Where can I buy Sodium chromotropate?

You can request a quote for Sodium chromotropate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Sodium chromotropate?

Yes, CoreyChem provides custom synthesis services for Sodium chromotropate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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