Ammonium, decyldimethyl(2-hydroxyethyl)-, bromide, benzilate
TL;DR: Ammonium, decyldimethyl(2-hydroxyethyl)-, bromide, benzilate (CAS 55019-68-6) is a chemical compound with molecular formula C28H42BrNO3 and molecular weight 519.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
decyl-[2-(2-hydroxy-2,2-diphenylacetyl)oxyethyl]-dimethylazanium bromide
Also Known As: Decyl-dimethyl(2-hydroxyethyl)ammonium bromide benzilate, Benzilsaeure-dimethyl-decyl-ammonium-aethylester-bromide, Benzilsaeure-dimethyl-decyl-ammonium-aethylester-bromide [German], AMMONIUM, DECYLDIMETHYL(2-HYDROXYETHYL)-, BROMIDE, BENZILATE, decyl-[2-(2-hydroxy-2,2-diphenylacetyl)oxyethyl]-dimethylazanium bromide
| Molecular Formula | C28H42BrNO3 |
|---|---|
| Molecular Weight | 519.23 g/mol |
| LogP | 2.69 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 16 |
| Exact Mass | 519.2348 |
| Heavy Atoms | 33 |
| Complexity | 489.0 |
Chemical Identifiers
| CAS Number | 55019-68-6 |
|---|---|
| SMILES | CCCCCCCCCC[N+](C)(C)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O.[Br-] |
| InChIKey | CFULZJWWLMNOED-UHFFFAOYSA-M |
Product Overview
Ammonium, decyldimethyl(2-hydroxyethyl)-, bromide, benzilate (CAS 55019-68-6), with molecular formula C28H42BrNO3 and molecular weight 519.23 g/mol. IUPAC: decyl-[2-(2-hydroxy-2,2-diphenylacetyl)oxyethyl]-dimethylazanium bromide.
Chemical Property Profile of Ammonium, decyldimethyl(2-hydroxyethyl)-, bromide, benzilate
Property Insights of Ammonium, decyldimethyl(2-hydroxyethyl)-, bromide, benzilate
The XLogP value of 2.69 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium, decyldimethyl(2-hydroxyethyl)-, bromide, benzilate. With a topological polar surface area (TPSA) of 46.5 Ų, Ammonium, decyldimethyl(2-hydroxyethyl)-, bromide, benzilate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, decyldimethyl(2-hydroxyethyl)-, bromide, benzilate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ammonium, decyldimethyl(2-hydroxyethyl)-, bromide, benzilate?
The CAS number of Ammonium, decyldimethyl(2-hydroxyethyl)-, bromide, benzilate is 55019-68-6.
What is the molecular formula of Ammonium, decyldimethyl(2-hydroxyethyl)-, bromide, benzilate?
The molecular formula of Ammonium, decyldimethyl(2-hydroxyethyl)-, bromide, benzilate is C28H42BrNO3.
What is the molecular weight of Ammonium, decyldimethyl(2-hydroxyethyl)-, bromide, benzilate?
The molecular weight of Ammonium, decyldimethyl(2-hydroxyethyl)-, bromide, benzilate is 519.23 g/mol.
Where can I buy Ammonium, decyldimethyl(2-hydroxyethyl)-, bromide, benzilate?
You can request a quote for Ammonium, decyldimethyl(2-hydroxyethyl)-, bromide, benzilate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium, decyldimethyl(2-hydroxyethyl)-, bromide, benzilate?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, decyldimethyl(2-hydroxyethyl)-, bromide, benzilate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.