Diethyl(4-methylbenzyl)amine
TL;DR: Diethyl(4-methylbenzyl)amine (CAS 34306-01-9) is a chemical compound with molecular formula C12H19N and molecular weight 177.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-ethyl-N-[(4-methylphenyl)methyl]ethanamine
Also Known As: Diethyl(4-methylbenzyl)amine, N-Ethyl-N-(4-methylbenzyl)ethanamine, N,N-diethyl-4-methylbenzylamine, N,N-Diethyl-4-methylbenzenemethanamine, N,N-Diethyl-4-methylbenzenemethaneamine
| Molecular Formula | C12H19N |
|---|---|
| Molecular Weight | 177.15 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 177.15175 |
| Heavy Atoms | 13 |
| Complexity | 121.0 |
Chemical Identifiers
| CAS Number | 34306-01-9 |
|---|---|
| SMILES | CCN(CC)CC1=CC=C(C=C1)C |
| InChIKey | HCJZYTOTRSBGAQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diethyl(4-methylbenzyl)amine (CAS 34306-01-9), with molecular formula C12H19N and molecular weight 177.15 g/mol. IUPAC: N-ethyl-N-[(4-methylphenyl)methyl]ethanamine.
Chemical Property Profile of Diethyl(4-methylbenzyl)amine
Property Insights of Diethyl(4-methylbenzyl)amine
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl(4-methylbenzyl)amine. With a topological polar surface area (TPSA) of 3.2 Ų, Diethyl(4-methylbenzyl)amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl(4-methylbenzyl)amine 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 Diethyl(4-methylbenzyl)amine?
The CAS number of Diethyl(4-methylbenzyl)amine is 34306-01-9.
What is the molecular formula of Diethyl(4-methylbenzyl)amine?
The molecular formula of Diethyl(4-methylbenzyl)amine is C12H19N.
What is the molecular weight of Diethyl(4-methylbenzyl)amine?
The molecular weight of Diethyl(4-methylbenzyl)amine is 177.15 g/mol.
Where can I buy Diethyl(4-methylbenzyl)amine?
You can request a quote for Diethyl(4-methylbenzyl)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl(4-methylbenzyl)amine?
Yes, KEHONG BIO provides custom synthesis services for Diethyl(4-methylbenzyl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.