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3-Hydroxy-4-[2-(4-methyl-3-sulfophenyl)diazenyl]-2-naphthalenecarboxylic acid structure
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3-Hydroxy-4-[2-(4-methyl-3-sulfophenyl)diazenyl]-2-naphthalenecarboxylic acid

TL;DR: 3-Hydroxy-4-[2-(4-methyl-3-sulfophenyl)diazenyl]-2-naphthalenecarboxylic acid (CAS 118040-35-0) is a chemical compound with molecular formula C18H14N2O6S and molecular weight 386.05725 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-hydroxy-4-[(4-methyl-3-sulfophenyl)diazenyl]naphthalene-2-carboxylic acid

Also Known As: 3-Hydroxy-4-(4-methyl-3-sulfophenylazo)-2-naphthalenecarboxylic acid, (4E)-4-[(4-methyl-3-sulfo-phenyl)hydrazinylidene]-3-oxo-naphthalene-2-carboxylic Acid, (4Z)-4-[(4-methyl-3-sulfophenyl)hydrazinylidene]-3-oxonaphthalene-2-carboxylic acid, 3-hydroxy-4-[2-(4-methyl-3-sulfophenyl)diazen-1-yl]naphthalene-2-carboxylic acid, 3-Hydroxy-4-[2-(4-methyl-3-sulfophenyl)diazenyl]-2-naphthalenecarboxylic acid

CAS Number
118040-35-0
Molecular Formula
C18H14N2O6S
Molecular Weight
386.05725 g/mol
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Application Areas

Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.

Construction Chemicals (1 patents) Dyes & Pigments (6 patents) Pharmaceutical Intermediates (1 patents)

Technical Specifications

Molecular FormulaC18H14N2O6S
Molecular Weight386.05725 g/mol
XLogP3.8
Topological Polar Surface Area (TPSA)145.0 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors8
Rotatable Bonds4
Exact Mass386.05725 Da
Heavy Atoms27
Complexity676.0
SMILESCC1=C(C=C(C=C1)N=NC2=C(C(=CC3=CC=CC=C32)C(=O)O)O)S(=O)(=O)O
InChIKeyZGDOXNSJDDJHRV-UHFFFAOYSA-N

Chemical Property Profile of 3-Hydroxy-4-[2-(4-methyl-3-sulfophenyl)diazenyl]-2-naphthalenecarboxylic acid

XLogP
3.8
TPSA (Topological Polar Surface Area)
145.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
8
Rotatable Bonds
4
Heavy Atoms
27
Complexity
676.0
Exact Mass
386.05725
Monoisotopic Mass
386.05725
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 3-Hydroxy-4-[2-(4-methyl-3-sulfophenyl)diazenyl]-2-naphthalenecarboxylic acid

The XLogP value of 3.8 indicates that 3-Hydroxy-4-[2-(4-methyl-3-sulfophenyl)diazenyl]-2-naphthalenecarboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 145.0 Ų indicates high polarity, suggesting 3-Hydroxy-4-[2-(4-methyl-3-sulfophenyl)diazenyl]-2-naphthalenecarboxylic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-Hydroxy-4-[2-(4-methyl-3-sulfophenyl)diazenyl]-2-naphthalenecarboxylic acid has 3 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 3-Hydroxy-4-[2-(4-methyl-3-sulfophenyl)diazenyl]-2-naphthalenecarboxylic acid?

The CAS number of 3-Hydroxy-4-[2-(4-methyl-3-sulfophenyl)diazenyl]-2-naphthalenecarboxylic acid is 118040-35-0.

What is the molecular formula of 3-Hydroxy-4-[2-(4-methyl-3-sulfophenyl)diazenyl]-2-naphthalenecarboxylic acid?

The molecular formula of 3-Hydroxy-4-[2-(4-methyl-3-sulfophenyl)diazenyl]-2-naphthalenecarboxylic acid is C18H14N2O6S.

What is the molecular weight of 3-Hydroxy-4-[2-(4-methyl-3-sulfophenyl)diazenyl]-2-naphthalenecarboxylic acid?

The molecular weight of 3-Hydroxy-4-[2-(4-methyl-3-sulfophenyl)diazenyl]-2-naphthalenecarboxylic acid is 386.05725 g/mol.

Where can I buy 3-Hydroxy-4-[2-(4-methyl-3-sulfophenyl)diazenyl]-2-naphthalenecarboxylic acid?

You can request a quote for 3-Hydroxy-4-[2-(4-methyl-3-sulfophenyl)diazenyl]-2-naphthalenecarboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 3-Hydroxy-4-[2-(4-methyl-3-sulfophenyl)diazenyl]-2-naphthalenecarboxylic acid?

Yes, CoreyChem provides custom synthesis services for 3-Hydroxy-4-[2-(4-methyl-3-sulfophenyl)diazenyl]-2-naphthalenecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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