Diphenhydramine Laurylsulfate
TL;DR: Diphenhydramine Laurylsulfate (CAS 103659-13-8) is a chemical compound with molecular formula C29H47NO5S and molecular weight 521.3175 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-benzhydryloxy-N,N-dimethylethanamine;dodecyl hydrogen sulfate
Also Known As: Diphenhydramine laurylsulfate, Vena (TN), Diphenhydramine laurylsulfate [JAN], Dodecyl sulfate, diphenhydramine salt, 58-73-1, Diphenhydramine
Technical Specifications
| Molecular Formula | C29H47NO5S |
| Molecular Weight | 521.3175 g/mol |
| XLogP | 7.0809 |
| Topological Polar Surface Area (TPSA) | 84.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 18 |
| Exact Mass | 521.3175 Da |
| Heavy Atoms | 36 |
| Complexity | 455.0 |
| SMILES | CCCCCCCCCCCCOS(=O)(=O)O.CN(C)CCOC(C1=CC=CC=C1)C2=CC=CC=C2 |
| InChIKey | AJZFEQIFKBZILH-UHFFFAOYSA-N |
Chemical Property Profile of Diphenhydramine Laurylsulfate
Property Insights of Diphenhydramine Laurylsulfate
The XLogP value of 7.0809 indicates that Diphenhydramine Laurylsulfate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Diphenhydramine Laurylsulfate. Following Lipinski's Rule of Five, Diphenhydramine Laurylsulfate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Diphenhydramine Laurylsulfate?
The CAS number of Diphenhydramine Laurylsulfate is 103659-13-8.
What is the molecular formula of Diphenhydramine Laurylsulfate?
The molecular formula of Diphenhydramine Laurylsulfate is C29H47NO5S.
What is the molecular weight of Diphenhydramine Laurylsulfate?
The molecular weight of Diphenhydramine Laurylsulfate is 521.3175 g/mol.
Where can I buy Diphenhydramine Laurylsulfate?
You can request a quote for Diphenhydramine Laurylsulfate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Diphenhydramine Laurylsulfate?
Yes, CoreyChem provides custom synthesis services for Diphenhydramine Laurylsulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.