(4-Phenylphenyl)sulfonylmethylphosphonic acid
TL;DR: (4-Phenylphenyl)sulfonylmethylphosphonic acid (CAS 653588-44-4) is a chemical compound with molecular formula C13H13O5PS and molecular weight 312.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-phenylphenyl)sulfonylmethylphosphonic acid
Also Known As: (4-phenylphenyl)sulfonylmethylphosphonic acid, (Biphenyl-4-sulfinyl)-acetic acid, (Biphenyl-4-sulfonylmethyl)-phosphonic acid, [([1,1'-Biphenyl]-4-sulfonyl)methyl]phosphonic acid, Phosphonic acid, [([1,1'-biphenyl]-4-ylsulfonyl)methyl]-
| Molecular Formula | C13H13O5PS |
|---|---|
| Molecular Weight | 312.02 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.02213 |
| Heavy Atoms | 20 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 653588-44-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)CP(=O)(O)O |
| InChIKey | XHVXONOXJYWLGL-UHFFFAOYSA-N |
Product Overview
(4-Phenylphenyl)sulfonylmethylphosphonic acid (CAS 653588-44-4), with molecular formula C13H13O5PS and molecular weight 312.02 g/mol. IUPAC: (4-phenylphenyl)sulfonylmethylphosphonic acid.
Chemical Property Profile of (4-Phenylphenyl)sulfonylmethylphosphonic acid
Property Insights of (4-Phenylphenyl)sulfonylmethylphosphonic acid
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Phenylphenyl)sulfonylmethylphosphonic acid. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Phenylphenyl)sulfonylmethylphosphonic acid. Following Lipinski's Rule of Five, (4-Phenylphenyl)sulfonylmethylphosphonic acid has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (4-Phenylphenyl)sulfonylmethylphosphonic acid?
The CAS number of (4-Phenylphenyl)sulfonylmethylphosphonic acid is 653588-44-4.
What is the molecular formula of (4-Phenylphenyl)sulfonylmethylphosphonic acid?
The molecular formula of (4-Phenylphenyl)sulfonylmethylphosphonic acid is C13H13O5PS.
What is the molecular weight of (4-Phenylphenyl)sulfonylmethylphosphonic acid?
The molecular weight of (4-Phenylphenyl)sulfonylmethylphosphonic acid is 312.02 g/mol.
Where can I buy (4-Phenylphenyl)sulfonylmethylphosphonic acid?
You can request a quote for (4-Phenylphenyl)sulfonylmethylphosphonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Phenylphenyl)sulfonylmethylphosphonic acid?
Yes, KEHONG BIO provides custom synthesis services for (4-Phenylphenyl)sulfonylmethylphosphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.