Diethylmethylphenylammonium
TL;DR: Diethylmethylphenylammonium (CAS 310-42-9) is a chemical compound with molecular formula C11H18N+ and molecular weight 164.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-methyl-phenylazanium
Also Known As: Diethylmethylphenylammonium, N,N-diethyl-N-methylanilinium, diethyl-methyl-phenylazanium, Benzenaminium, N,N-diethyl-N-methyl-, J1.558.909D
| Molecular Formula | C11H18N+ |
|---|---|
| Molecular Weight | 164.14 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 164.14392 |
| Heavy Atoms | 12 |
| Complexity | 121.0 |
Chemical Identifiers
| CAS Number | 310-42-9 |
|---|---|
| SMILES | CC[N+](C)(CC)C1=CC=CC=C1 |
| InChIKey | VXXRVQGAGIGJHM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diethylmethylphenylammonium (CAS 310-42-9), with molecular formula C11H18N+ and molecular weight 164.14 g/mol. IUPAC: diethyl-methyl-phenylazanium.
Chemical Property Profile of Diethylmethylphenylammonium
Property Insights of Diethylmethylphenylammonium
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethylmethylphenylammonium. With a topological polar surface area (TPSA) of 0.0 Ų, Diethylmethylphenylammonium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethylmethylphenylammonium has 0 hydrogen bond donor(s) and 0 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 Diethylmethylphenylammonium?
The CAS number of Diethylmethylphenylammonium is 310-42-9.
What is the molecular formula of Diethylmethylphenylammonium?
The molecular formula of Diethylmethylphenylammonium is C11H18N+.
What is the molecular weight of Diethylmethylphenylammonium?
The molecular weight of Diethylmethylphenylammonium is 164.14 g/mol.
Where can I buy Diethylmethylphenylammonium?
You can request a quote for Diethylmethylphenylammonium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethylmethylphenylammonium?
Yes, KEHONG BIO provides custom synthesis services for Diethylmethylphenylammonium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.