Benzenesulfonic acid, dodecyl-, compd. with 4,4-dimethyloxazolidine (1:1)
TL;DR: Benzenesulfonic acid, dodecyl-, compd. with 4,4-dimethyloxazolidine (1:1) (CAS 79058-63-2) is a chemical compound with molecular formula C23H41NO4S and molecular weight 427.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-dimethyl-1,3-oxazolidine;2-dodecylbenzenesulfonic acid
Also Known As: Benzenesulfonic acid, dodecyl-, compd. with 4,4-dimethyloxazolidine (1:1), Dodecylbenzenesulfonic acid, 4,4-dimethyloxazolidine salt, 2-dodecylbenzenesulfonic acid- 4,4-dimethyl-1,3-oxazolidine(1:1), Dodecylbenzenesulfonic acid,4,4-dimethyloxazolidine salt, Dodecylbenzenesulphonic acid, compound with 4,4-dimethyloxazolidine (1:1)
| Molecular Formula | C23H41NO4S |
|---|---|
| Molecular Weight | 427.28 g/mol |
| LogP | 5.739 |
| Topological Polar Surface Area | 84.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 427.27563 |
| Heavy Atoms | 29 |
| Complexity | 429.0 |
Chemical Identifiers
| CAS Number | 79058-63-2 |
|---|---|
| SMILES | CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O.CC1(COCN1)C |
| InChIKey | RZJHMXNKJSOXRL-UHFFFAOYSA-N |
Product Overview
Benzenesulfonic acid, dodecyl-, compd. with 4,4-dimethyloxazolidine (1:1) (CAS 79058-63-2), with molecular formula C23H41NO4S and molecular weight 427.28 g/mol. IUPAC: 4,4-dimethyl-1,3-oxazolidine;2-dodecylbenzenesulfonic acid.
Chemical Property Profile of Benzenesulfonic acid, dodecyl-, compd. with 4,4-dimethyloxazolidine (1:1)
Property Insights of Benzenesulfonic acid, dodecyl-, compd. with 4,4-dimethyloxazolidine (1:1)
The XLogP value of 5.739 indicates that Benzenesulfonic acid, dodecyl-, compd. with 4,4-dimethyloxazolidine (1:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenesulfonic acid, dodecyl-, compd. with 4,4-dimethyloxazolidine (1:1). Following Lipinski's Rule of Five, Benzenesulfonic acid, dodecyl-, compd. with 4,4-dimethyloxazolidine (1:1) has 2 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 Benzenesulfonic acid, dodecyl-, compd. with 4,4-dimethyloxazolidine (1:1)?
The CAS number of Benzenesulfonic acid, dodecyl-, compd. with 4,4-dimethyloxazolidine (1:1) is 79058-63-2.
What is the molecular formula of Benzenesulfonic acid, dodecyl-, compd. with 4,4-dimethyloxazolidine (1:1)?
The molecular formula of Benzenesulfonic acid, dodecyl-, compd. with 4,4-dimethyloxazolidine (1:1) is C23H41NO4S.
What is the molecular weight of Benzenesulfonic acid, dodecyl-, compd. with 4,4-dimethyloxazolidine (1:1)?
The molecular weight of Benzenesulfonic acid, dodecyl-, compd. with 4,4-dimethyloxazolidine (1:1) is 427.28 g/mol.
Where can I buy Benzenesulfonic acid, dodecyl-, compd. with 4,4-dimethyloxazolidine (1:1)?
You can request a quote for Benzenesulfonic acid, dodecyl-, compd. with 4,4-dimethyloxazolidine (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenesulfonic acid, dodecyl-, compd. with 4,4-dimethyloxazolidine (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Benzenesulfonic acid, dodecyl-, compd. with 4,4-dimethyloxazolidine (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.