4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid
TL;DR: 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid (CAS 124243-00-1) is a chemical compound with molecular formula C25H24O7S2 and molecular weight 500.09634 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[3-(4-methylphenyl)sulfonyl-2-[(4-methylphenyl)sulfonylmethyl]propanoyl]benzoic acid
Also Known As: 4-(3-tosyl-2-(tosylmethyl)propanoyl)benzoic acid, Bis-sulfone Acid, nchembio786-comp1, 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoicacid, Benzoic acid,4-[3-[(4-methylphenyl)sulfonyl]-2-[[(4-methylphenyl)sulfonyl]methyl]-1-oxopropyl]-
Technical Specifications
| Molecular Formula | C25H24O7S2 |
| Molecular Weight | 500.09634 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 139.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 500.09634 Da |
| Heavy Atoms | 34 |
| Complexity | 851.0 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)CC(CS(=O)(=O)C2=CC=C(C=C2)C)C(=O)C3=CC=C(C=C3)C(=O)O |
| InChIKey | HGOBHXGITKMPPL-UHFFFAOYSA-N |
Chemical Property Profile of 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid
Property Insights of 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid
The XLogP value of 3.7 indicates that 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid. Following Lipinski's Rule of Five, 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid?
The CAS number of 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid is 124243-00-1.
What is the molecular formula of 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid?
The molecular formula of 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid is C25H24O7S2.
What is the molecular weight of 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid?
The molecular weight of 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid is 500.09634 g/mol.
Where can I buy 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid?
You can request a quote for 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid?
Yes, CoreyChem provides custom synthesis services for 4-(3-Tosyl-2-(tosylmethyl)propanoyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.