(R-(R*,S*))-dodecyldimethyl(alpha-methylphenacyl)ammonium bromide
TL;DR: (R-(R*,S*))-dodecyldimethyl(alpha-methylphenacyl)ammonium bromide (CAS 57155-63-2) is a chemical compound with molecular formula C23H40BrNO and molecular weight 425.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dodecyl-dimethyl-[(2R)-1-oxo-1-phenylpropan-2-yl]azanium bromide
Also Known As: dodecyl ephedrinium bromide, EINECS 260-596-5, (-)-N-Dodecyl-N-methylephedrinium bromide, (R-(R*,S*))-Dodecyldimethyl(alpha-methylphenacyl)ammonium bromide, 5-[4-(Trifluoromethyl)phenyl]-1H-tetrazole
| Molecular Formula | C23H40BrNO |
|---|---|
| Molecular Weight | 425.23 g/mol |
| LogP | 3.2591 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 14 |
| Exact Mass | 425.22934 |
| Heavy Atoms | 26 |
| Complexity | 472.356 |
Chemical Identifiers
| CAS Number | 57155-63-2 |
|---|---|
| SMILES | CCCCCCCCCCCC[N+](C)(C)[C@H](C)C(=O)C1=CC=CC=C1.[Br-] |
Product Overview
(R-(R*,S*))-dodecyldimethyl(alpha-methylphenacyl)ammonium bromide (CAS 57155-63-2), with molecular formula C23H40BrNO and molecular weight 425.23 g/mol. IUPAC: dodecyl-dimethyl-[(2R)-1-oxo-1-phenylpropan-2-yl]azanium bromide.
Chemical Property Profile of (R-(R*,S*))-dodecyldimethyl(alpha-methylphenacyl)ammonium bromide
Property Insights of (R-(R*,S*))-dodecyldimethyl(alpha-methylphenacyl)ammonium bromide
The XLogP value of 3.2591 indicates that (R-(R*,S*))-dodecyldimethyl(alpha-methylphenacyl)ammonium bromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, (R-(R*,S*))-dodecyldimethyl(alpha-methylphenacyl)ammonium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (R-(R*,S*))-dodecyldimethyl(alpha-methylphenacyl)ammonium bromide has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (R-(R*,S*))-dodecyldimethyl(alpha-methylphenacyl)ammonium bromide?
The CAS number of (R-(R*,S*))-dodecyldimethyl(alpha-methylphenacyl)ammonium bromide is 57155-63-2.
What is the molecular formula of (R-(R*,S*))-dodecyldimethyl(alpha-methylphenacyl)ammonium bromide?
The molecular formula of (R-(R*,S*))-dodecyldimethyl(alpha-methylphenacyl)ammonium bromide is C23H40BrNO.
What is the molecular weight of (R-(R*,S*))-dodecyldimethyl(alpha-methylphenacyl)ammonium bromide?
The molecular weight of (R-(R*,S*))-dodecyldimethyl(alpha-methylphenacyl)ammonium bromide is 425.23 g/mol.
Where can I buy (R-(R*,S*))-dodecyldimethyl(alpha-methylphenacyl)ammonium bromide?
You can request a quote for (R-(R*,S*))-dodecyldimethyl(alpha-methylphenacyl)ammonium bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (R-(R*,S*))-dodecyldimethyl(alpha-methylphenacyl)ammonium bromide?
Yes, KEHONG BIO provides custom synthesis services for (R-(R*,S*))-dodecyldimethyl(alpha-methylphenacyl)ammonium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.