Benzenemethanamine, N,N-diethyl-
TL;DR: Benzenemethanamine, N,N-diethyl- (CAS 772-54-3) is a chemical compound with molecular formula C11H17N and molecular weight 163.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-N-ethylethanamine
Also Known As: N-Benzyl-N-ethylethanamine, N-Benzyldiethylamine, N,N-DIETHYLBENZYLAMINE, Benzyldiethylamine, Diethylbenzylamine
| Molecular Formula | C11H17N |
|---|---|
| Molecular Weight | 163.14 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 163.1361 |
| Heavy Atoms | 12 |
| Complexity | 102.0 |
Chemical Identifiers
| CAS Number | 772-54-3 |
|---|---|
| SMILES | CCN(CC)CC1=CC=CC=C1 |
| InChIKey | ZWRDBWDXRLPESY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzenemethanamine, N,N-diethyl- (CAS 772-54-3), with molecular formula C11H17N and molecular weight 163.14 g/mol. IUPAC: N-benzyl-N-ethylethanamine.
Chemical Property Profile of Benzenemethanamine, N,N-diethyl-
Property Insights of Benzenemethanamine, N,N-diethyl-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenemethanamine, N,N-diethyl-. With a topological polar surface area (TPSA) of 3.2 Ų, Benzenemethanamine, N,N-diethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenemethanamine, N,N-diethyl- 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 Benzenemethanamine, N,N-diethyl-?
The CAS number of Benzenemethanamine, N,N-diethyl- is 772-54-3.
What is the molecular formula of Benzenemethanamine, N,N-diethyl-?
The molecular formula of Benzenemethanamine, N,N-diethyl- is C11H17N.
What is the molecular weight of Benzenemethanamine, N,N-diethyl-?
The molecular weight of Benzenemethanamine, N,N-diethyl- is 163.14 g/mol.
Where can I buy Benzenemethanamine, N,N-diethyl-?
You can request a quote for Benzenemethanamine, N,N-diethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenemethanamine, N,N-diethyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzenemethanamine, N,N-diethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.