N,N-Diethylaniline
TL;DR: N,N-Diethylaniline (CAS 91-66-7) is a chemical compound with molecular formula C10H15N and molecular weight 149.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethylaniline
Also Known As: N,N-DIETHYLANILINE, Diethylaniline, Diethylphenylamine, Diaethylanilin, N,N-Diethylanilin
| Molecular Formula | C10H15N |
|---|---|
| Molecular Weight | 149.12 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 149.12045 |
| Heavy Atoms | 11 |
| Complexity | 91.0 |
| Melting Point | -38.8 °C |
| Boiling Point | 215.5 °C at 760 mmHg ; 92.2 °C at 10 mmHg |
| Density | 0.906 - Less dense than water; will float |
| Solubility | less than 1 mg/mL at 76.1 °F (NTP, 1992) |
| Flash Point | 85.0 °C |
| Vapor Pressure | 1 mmHg at 49.7 °C |
| Refractive Index | 1.5409 @ 20 °C |
Chemical Identifiers
| CAS Number | 91-66-7 |
|---|---|
| SMILES | CCN(CC)C1=CC=CC=C1 |
| InChIKey | GGSUCNLOZRCGPQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N-Diethylaniline (CAS 91-66-7), with molecular formula C10H15N and molecular weight 149.12 g/mol. IUPAC: N,N-diethylaniline.
Chemical Property Profile of N,N-Diethylaniline
Property Insights of N,N-Diethylaniline
The XLogP value of 3.3 indicates that N,N-Diethylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, N,N-Diethylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Diethylaniline 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 N,N-Diethylaniline?
The CAS number of N,N-Diethylaniline is 91-66-7.
What is the molecular formula of N,N-Diethylaniline?
The molecular formula of N,N-Diethylaniline is C10H15N.
What is the molecular weight of N,N-Diethylaniline?
The molecular weight of N,N-Diethylaniline is 149.12 g/mol.
Where can I buy N,N-Diethylaniline?
You can request a quote for N,N-Diethylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Diethylaniline?
Yes, KEHONG BIO provides custom synthesis services for N,N-Diethylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.