(Decylsulfonyl)acetic acid
TL;DR: (Decylsulfonyl)acetic acid (CAS 6296-64-6) is a chemical compound with molecular formula C12H24O4S and molecular weight 264.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-decylsulfonylacetic acid
Also Known As: (decylsulfonyl)acetic acid, 2-decylsulfonylacetic acid, Acetic acid, (decylsulfonyl)-, (decane-1-sulfonyl)-acetic acid, KST-1A6754
| Molecular Formula | C12H24O4S |
|---|---|
| Molecular Weight | 264.14 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 79.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 264.13953 |
| Heavy Atoms | 17 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 6296-64-6 |
|---|---|
| SMILES | CCCCCCCCCCS(=O)(=O)CC(=O)O |
| InChIKey | CSRVRDJOQWLXHK-UHFFFAOYSA-N |
Product Overview
(Decylsulfonyl)acetic acid (CAS 6296-64-6), with molecular formula C12H24O4S and molecular weight 264.14 g/mol. IUPAC: 2-decylsulfonylacetic acid.
Chemical Property Profile of (Decylsulfonyl)acetic acid
Property Insights of (Decylsulfonyl)acetic acid
The XLogP value of 3.7 indicates that (Decylsulfonyl)acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (Decylsulfonyl)acetic acid. Following Lipinski's Rule of Five, (Decylsulfonyl)acetic 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
Frequently Asked Questions
What is the CAS number of (Decylsulfonyl)acetic acid?
The CAS number of (Decylsulfonyl)acetic acid is 6296-64-6.
What is the molecular formula of (Decylsulfonyl)acetic acid?
The molecular formula of (Decylsulfonyl)acetic acid is C12H24O4S.
What is the molecular weight of (Decylsulfonyl)acetic acid?
The molecular weight of (Decylsulfonyl)acetic acid is 264.14 g/mol.
Where can I buy (Decylsulfonyl)acetic acid?
You can request a quote for (Decylsulfonyl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Decylsulfonyl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (Decylsulfonyl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.