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Niacinamide salicylate structure
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Niacinamide salicylate

TL;DR: Niacinamide salicylate (CAS 66634-12-6) is a chemical compound with molecular formula C13H12N2O4 and molecular weight 260.0797 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-hydroxybenzoic acid;pyridine-3-carboxamide

Also Known As: Niksalin, Niksalin [German], Niacinamide salicylate, Nicotinamide salicylate, Nicotinamid-salicylat

CAS Number
66634-12-6
Molecular Formula
C13H12N2O4
Molecular Weight
260.0797 g/mol
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Application Areas

Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.

Pharmaceutical Intermediates (23 patents)

Technical Specifications

Molecular FormulaC13H12N2O4
Molecular Weight260.0797 g/mol
XLogP1.27
Topological Polar Surface Area (TPSA)114.0 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors5
Rotatable Bonds2
Exact Mass260.0797 Da
Heavy Atoms19
Complexity246.0
SMILESC1=CC=C(C(=C1)C(=O)O)O.C1=CC(=CN=C1)C(=O)N
InChIKeyHXLQIJRKKFMNGU-UHFFFAOYSA-N

Chemical Property Profile of Niacinamide salicylate

XLogP
1.27
TPSA (Topological Polar Surface Area)
114.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
5
Rotatable Bonds
2
Heavy Atoms
19
Complexity
246.0
Exact Mass
260.0797
Monoisotopic Mass
260.0797
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 Niacinamide salicylate

The XLogP value of 1.27 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Niacinamide salicylate. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Niacinamide salicylate. Following Lipinski's Rule of Five, Niacinamide salicylate has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Niacinamide salicylate?

The CAS number of Niacinamide salicylate is 66634-12-6.

What is the molecular formula of Niacinamide salicylate?

The molecular formula of Niacinamide salicylate is C13H12N2O4.

What is the molecular weight of Niacinamide salicylate?

The molecular weight of Niacinamide salicylate is 260.0797 g/mol.

Where can I buy Niacinamide salicylate?

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

Does CoreyChem offer custom synthesis for Niacinamide salicylate?

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

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