Diethylamine, 2-bromo-2'-iodo-N-methyl-, hydrochloride
TL;DR: Diethylamine, 2-bromo-2'-iodo-N-methyl-, hydrochloride (CAS 54955-02-1) is a chemical compound with molecular formula C5H12BrClIN and molecular weight 326.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromoethyl-(2-iodoethyl)-methylazanium chloride
Also Known As: 2-Bromo-2'-iodo-N-methyldiethylamine hydrochloride, 2-bromoethyl-(2-iodoethyl)-methylazanium chloride, DIETHYLAMINE, 2-BROMO-2'-IODO-N-METHYL-, HYDROCHLORIDE, RefChem:1083526
| Molecular Formula | C5H12BrClIN |
|---|---|
| Molecular Weight | 326.89 g/mol |
| LogP | -2.66 |
| Topological Polar Surface Area | 4.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 326.88864 |
| Heavy Atoms | 9 |
| Complexity | 51.0 |
Chemical Identifiers
| CAS Number | 54955-02-1 |
|---|---|
| SMILES | C[NH+](CCBr)CCI.[Cl-] |
| InChIKey | IWZRLWNTUPNIHQ-UHFFFAOYSA-N |
Product Overview
Diethylamine, 2-bromo-2'-iodo-N-methyl-, hydrochloride (CAS 54955-02-1), with molecular formula C5H12BrClIN and molecular weight 326.89 g/mol. IUPAC: 2-bromoethyl-(2-iodoethyl)-methylazanium chloride.
Chemical Property Profile of Diethylamine, 2-bromo-2'-iodo-N-methyl-, hydrochloride
Property Insights of Diethylamine, 2-bromo-2'-iodo-N-methyl-, hydrochloride
The XLogP value of -2.66 indicates that Diethylamine, 2-bromo-2'-iodo-N-methyl-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 4.4 Ų, Diethylamine, 2-bromo-2'-iodo-N-methyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethylamine, 2-bromo-2'-iodo-N-methyl-, hydrochloride 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 Diethylamine, 2-bromo-2'-iodo-N-methyl-, hydrochloride?
The CAS number of Diethylamine, 2-bromo-2'-iodo-N-methyl-, hydrochloride is 54955-02-1.
What is the molecular formula of Diethylamine, 2-bromo-2'-iodo-N-methyl-, hydrochloride?
The molecular formula of Diethylamine, 2-bromo-2'-iodo-N-methyl-, hydrochloride is C5H12BrClIN.
What is the molecular weight of Diethylamine, 2-bromo-2'-iodo-N-methyl-, hydrochloride?
The molecular weight of Diethylamine, 2-bromo-2'-iodo-N-methyl-, hydrochloride is 326.89 g/mol.
Where can I buy Diethylamine, 2-bromo-2'-iodo-N-methyl-, hydrochloride?
You can request a quote for Diethylamine, 2-bromo-2'-iodo-N-methyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethylamine, 2-bromo-2'-iodo-N-methyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Diethylamine, 2-bromo-2'-iodo-N-methyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.