5-(Chlorosulfonyl)-2-(hexadecylsulfonyl)benzoic acid
TL;DR: 5-(Chlorosulfonyl)-2-(hexadecylsulfonyl)benzoic acid (CAS 29338-03-2) is a chemical compound with molecular formula C23H37ClO6S2 and molecular weight 508.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chlorosulfonyl-2-hexadecylsulfonylbenzoic acid
Also Known As: 5-(chlorosulfonyl)-2-(hexadecylsulfonyl)benzoic acid, 5-chlorosulfonyl-2-hexadecylsulfonyl-benzoic Acid, 5-chlorosulfonyl-2-hexadecylsulfonylbenzoic acid, 5-(Chlorosulfonyl)-2-(hexadecane-1-sulfonyl)benzoic acid, 653-339-7
| Molecular Formula | C23H37ClO6S2 |
|---|---|
| Molecular Weight | 508.17 g/mol |
| LogP | 6.5673 |
| Topological Polar Surface Area | 105.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 18 |
| Exact Mass | 508.172 |
| Heavy Atoms | 32 |
| Complexity | 910.41437 |
Chemical Identifiers
| CAS Number | 29338-03-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCS(=O)(=O)C1=C(C=C(C=C1)S(=O)(=O)Cl)C(=O)O |
Product Overview
5-(Chlorosulfonyl)-2-(hexadecylsulfonyl)benzoic acid (CAS 29338-03-2), with molecular formula C23H37ClO6S2 and molecular weight 508.17 g/mol. IUPAC: 5-chlorosulfonyl-2-hexadecylsulfonylbenzoic acid.
Chemical Property Profile of 5-(Chlorosulfonyl)-2-(hexadecylsulfonyl)benzoic acid
Property Insights of 5-(Chlorosulfonyl)-2-(hexadecylsulfonyl)benzoic acid
The XLogP value of 6.5673 indicates that 5-(Chlorosulfonyl)-2-(hexadecylsulfonyl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(Chlorosulfonyl)-2-(hexadecylsulfonyl)benzoic acid. Following Lipinski's Rule of Five, 5-(Chlorosulfonyl)-2-(hexadecylsulfonyl)benzoic acid has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-(Chlorosulfonyl)-2-(hexadecylsulfonyl)benzoic acid?
The CAS number of 5-(Chlorosulfonyl)-2-(hexadecylsulfonyl)benzoic acid is 29338-03-2.
What is the molecular formula of 5-(Chlorosulfonyl)-2-(hexadecylsulfonyl)benzoic acid?
The molecular formula of 5-(Chlorosulfonyl)-2-(hexadecylsulfonyl)benzoic acid is C23H37ClO6S2.
What is the molecular weight of 5-(Chlorosulfonyl)-2-(hexadecylsulfonyl)benzoic acid?
The molecular weight of 5-(Chlorosulfonyl)-2-(hexadecylsulfonyl)benzoic acid is 508.17 g/mol.
Where can I buy 5-(Chlorosulfonyl)-2-(hexadecylsulfonyl)benzoic acid?
You can request a quote for 5-(Chlorosulfonyl)-2-(hexadecylsulfonyl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Chlorosulfonyl)-2-(hexadecylsulfonyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-(Chlorosulfonyl)-2-(hexadecylsulfonyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.