(2-Cyanoethyl)(dimethyl)ammonium bromide
TL;DR: (2-Cyanoethyl)(dimethyl)ammonium bromide (CAS 253875-98-8) is a chemical compound with molecular formula C5H11BrN2 and molecular weight 178.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyanoethyl(dimethyl)azanium bromide
Also Known As: (2-cyanoethyl)(dimethyl)ammonium bromide, 2-cyanoethyl(dimethyl)azanium;bromide, 2-cyanoethyl(dimethyl)azanium, (2-cyanoethyl)dimethylazanium bromide, 2-cyanoethyl(dimethyl)azanium bromide
| Molecular Formula | C5H11BrN2 |
|---|---|
| Molecular Weight | 178.01 g/mol |
| LogP | -3.95142 |
| Topological Polar Surface Area | 28.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 178.01056 |
| Heavy Atoms | 8 |
| Complexity | 74.98808 |
Chemical Identifiers
| CAS Number | 253875-98-8 |
|---|---|
| SMILES | C[NH+](C)CCC#N.[Br-] |
Product Overview
(2-Cyanoethyl)(dimethyl)ammonium bromide (CAS 253875-98-8), with molecular formula C5H11BrN2 and molecular weight 178.01 g/mol. IUPAC: 2-cyanoethyl(dimethyl)azanium bromide.
Chemical Property Profile of (2-Cyanoethyl)(dimethyl)ammonium bromide
Property Insights of (2-Cyanoethyl)(dimethyl)ammonium bromide
The XLogP value of -3.95142 indicates that (2-Cyanoethyl)(dimethyl)ammonium bromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 28.23 Ų, (2-Cyanoethyl)(dimethyl)ammonium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Cyanoethyl)(dimethyl)ammonium bromide has 1 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 (2-Cyanoethyl)(dimethyl)ammonium bromide?
The CAS number of (2-Cyanoethyl)(dimethyl)ammonium bromide is 253875-98-8.
What is the molecular formula of (2-Cyanoethyl)(dimethyl)ammonium bromide?
The molecular formula of (2-Cyanoethyl)(dimethyl)ammonium bromide is C5H11BrN2.
What is the molecular weight of (2-Cyanoethyl)(dimethyl)ammonium bromide?
The molecular weight of (2-Cyanoethyl)(dimethyl)ammonium bromide is 178.01 g/mol.
Where can I buy (2-Cyanoethyl)(dimethyl)ammonium bromide?
You can request a quote for (2-Cyanoethyl)(dimethyl)ammonium bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Cyanoethyl)(dimethyl)ammonium bromide?
Yes, KEHONG BIO provides custom synthesis services for (2-Cyanoethyl)(dimethyl)ammonium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.