RefChem:72923
TL;DR: RefChem:72923 (CAS 103694-63-9) is a chemical compound with molecular formula C38H87N3O13S3 and molecular weight 889.5401 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl-[3-[4-[ethyl(dimethyl)azaniumyl]butyl-(2-hydroxyhexadecyl)-methylazaniumyl]propyl]-dimethylazanium;ethyl sulfate
Also Known As: 2,3,4,5-tetrahydro-1,4-benzothiazepin-3-one, ethyl-[3-[4-[ethyl(dimethyl)azaniumyl]butyl-(2-hydroxyhexadecyl)-methylazaniumyl]propyl]-dimethylazanium;ethyl sulfate, 1,3-Propanediaminium, N1,N3-diethyl-N1-(3-(ethyldimethylammonio)propyl)-N1-(2-hydroxyhexadecyl)-N3,N3-dimethyl-, ethyl sulfate (1:3), 1,3-Propanediaminium, N1,N3-diethyl-N1-[3-(ethyldimethylammonio)propyl]-N1-(2-hydroxyhexadecyl)-N3,N3-dimethyl-, ethyl sulfate (1:3), 1,3-Propanediaminium, N,N'-diethyl-N-(3-(ethyldimethylammonio)propyl)-N-(2-hydroxyhexadecyl)-N',N'-dimethyl-, tris(ethyl sulfate) (salt)
Technical Specifications
| Molecular Formula | C38H87N3O13S3 |
| Molecular Weight | 889.5401 g/mol |
| XLogP | 5.6973 |
| Topological Polar Surface Area (TPSA) | 245.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 29 |
| Exact Mass | 889.5401 Da |
| Heavy Atoms | 57 |
| Complexity | 598.0 |
| SMILES | CCCCCCCCCCCCCCC(C[N+](C)(CCCC[N+](C)(C)CC)CCC[N+](C)(C)CC)O.CCOS(=O)(=O)[O-].CCOS(=O)(=O)[O-].CCOS(=O)(=O)[O-] |
| InChIKey | JZTVHFRSYIDPPG-UHFFFAOYSA-K |
Product Description
Applications: RefChem:72923 is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies RefChem:72923 (CAS 103694-63-9) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A fine chemical supplied by CoreyChem, RefChem:72923 (CAS 103694-63-9) has the molecular formula C38H87N3O13S3 and a molecular weight of 889.54 g/mol. It is also known as 2,3,4,5-tetrahydro-1,4-benzothiazepin-3-one and ethyl-[3-[4-[ethyl(dimethyl)azaniumyl]butyl-(2-hydroxyhexadecyl)-methylazaniumyl]propyl]-dimethylazanium.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of RefChem:72923
Property Insights of RefChem:72923
The XLogP value of 5.6973 indicates that RefChem:72923 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 245.0 Ų indicates high polarity, suggesting RefChem:72923 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:72923 has 1 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:72923?
The CAS number of RefChem:72923 is 103694-63-9.
What is the molecular formula of RefChem:72923?
The molecular formula of RefChem:72923 is C38H87N3O13S3.
What is the molecular weight of RefChem:72923?
The molecular weight of RefChem:72923 is 889.5401 g/mol.
What are the applications of RefChem:72923?
RefChem:72923 is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies RefChem:72923 (CAS 103694-63-9) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and...
Where can I buy RefChem:72923?
You can request a quote for RefChem:72923 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:72923?
Yes, CoreyChem provides custom synthesis services for RefChem:72923 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.