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Polyanetholesulfonic Acid, Sodium Salt, Ultrapure structure
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Polyanetholesulfonic Acid, Sodium Salt, Ultrapure

TL;DR: Polyanetholesulfonic Acid, Sodium Salt, Ultrapure (CAS 55963-78-5) is a chemical compound with molecular formula C10H12NaO4S- and molecular weight 251.0354 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

sodium;1-methoxy-4-prop-1-enylbenzene;sulfite

Also Known As: Sodium polyanetholesulfonate, C10H12NaO4S-, polyanetholesulfonic acid sodium, POLYANETHOLESULFONIC ACID SODIUM SALT, Sodium;1-methoxy-4-prop-1-enylbenzene;sulfite

CAS Number
55963-78-5
Molecular Formula
C10H12NaO4S-
Molecular Weight
251.0354 g/mol
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Technical Specifications

Molecular FormulaC10H12NaO4S-
Molecular Weight251.0354 g/mol
XLogP-1.27
Topological Polar Surface Area (TPSA)91.6 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors5
Rotatable Bonds2
Exact Mass251.0354 Da
Heavy Atoms16
Complexity140.0
SMILESCC=CC1=CC=C(C=C1)OC.[O-]S(=O)[O-].[Na+]
InChIKeyJKJBFNAERWARKW-UHFFFAOYSA-L

Chemical Property Profile of Polyanetholesulfonic Acid, Sodium Salt, Ultrapure

XLogP
-1.27
TPSA (Topological Polar Surface Area)
91.6
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
5
Rotatable Bonds
2
Heavy Atoms
16
Complexity
140.0
Exact Mass
251.0354
Monoisotopic Mass
251.0354
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 Polyanetholesulfonic Acid, Sodium Salt, Ultrapure

The XLogP value of -1.27 indicates that Polyanetholesulfonic Acid, Sodium Salt, Ultrapure is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 91.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Polyanetholesulfonic Acid, Sodium Salt, Ultrapure. Following Lipinski's Rule of Five, Polyanetholesulfonic Acid, Sodium Salt, Ultrapure has 0 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 Polyanetholesulfonic Acid, Sodium Salt, Ultrapure?

The CAS number of Polyanetholesulfonic Acid, Sodium Salt, Ultrapure is 55963-78-5.

What is the molecular formula of Polyanetholesulfonic Acid, Sodium Salt, Ultrapure?

The molecular formula of Polyanetholesulfonic Acid, Sodium Salt, Ultrapure is C10H12NaO4S-.

What is the molecular weight of Polyanetholesulfonic Acid, Sodium Salt, Ultrapure?

The molecular weight of Polyanetholesulfonic Acid, Sodium Salt, Ultrapure is 251.0354 g/mol.

Where can I buy Polyanetholesulfonic Acid, Sodium Salt, Ultrapure?

You can request a quote for Polyanetholesulfonic Acid, Sodium Salt, Ultrapure directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Polyanetholesulfonic Acid, Sodium Salt, Ultrapure?

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

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