4-Octylsulfonylbutanoic acid
TL;DR: 4-Octylsulfonylbutanoic acid (CAS 132389-02-7) is a chemical compound with molecular formula C12H24O4S and molecular weight 264.13953 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-octylsulfonylbutanoic acid
Also Known As: 4-(octylsulfonyl)butanoic acid, 4-octylsulfonylbutanoic acid, 4-(octane-1-sulfonyl)-butyric acid, 4-(octane-1-sulfonyl)butanoic acid, J2.265.803D
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H24O4S |
| Molecular Weight | 264.13953 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 79.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 264.13953 Da |
| Heavy Atoms | 17 |
| Complexity | 290.0 |
| SMILES | CCCCCCCCS(=O)(=O)CCCC(=O)O |
| InChIKey | JKQCCJQZYOEDMC-UHFFFAOYSA-N |
Chemical Property Profile of 4-Octylsulfonylbutanoic acid
Property Insights of 4-Octylsulfonylbutanoic acid
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Octylsulfonylbutanoic acid. The TPSA of 79.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Octylsulfonylbutanoic acid. Following Lipinski's Rule of Five, 4-Octylsulfonylbutanoic acid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Octylsulfonylbutanoic acid?
The CAS number of 4-Octylsulfonylbutanoic acid is 132389-02-7.
What is the molecular formula of 4-Octylsulfonylbutanoic acid?
The molecular formula of 4-Octylsulfonylbutanoic acid is C12H24O4S.
What is the molecular weight of 4-Octylsulfonylbutanoic acid?
The molecular weight of 4-Octylsulfonylbutanoic acid is 264.13953 g/mol.
Where can I buy 4-Octylsulfonylbutanoic acid?
You can request a quote for 4-Octylsulfonylbutanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Octylsulfonylbutanoic acid?
Yes, CoreyChem provides custom synthesis services for 4-Octylsulfonylbutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.