N,N-diethyl-4-nitrosoaniline
TL;DR: N,N-diethyl-4-nitrosoaniline (CAS 120-22-9) is a chemical compound with molecular formula C10H14N2O and molecular weight 178.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-4-nitrosoaniline
Also Known As: N,N-Diethyl-4-nitrosoaniline, p-Nitrosodiethylaniline, 4-Nitroso-N,N-diethylaniline, Diethylnitrosoaniline, N,N-Diethyl-p-nitrosoaniline
| Molecular Formula | C10H14N2O |
|---|---|
| Molecular Weight | 178.11 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 178.11061 |
| Heavy Atoms | 13 |
| Complexity | 149.0 |
Chemical Identifiers
| CAS Number | 120-22-9 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)N=O |
| InChIKey | OLNMJIHADFYHAK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N-diethyl-4-nitrosoaniline (CAS 120-22-9), with molecular formula C10H14N2O and molecular weight 178.11 g/mol. IUPAC: N,N-diethyl-4-nitrosoaniline.
Chemical Property Profile of N,N-diethyl-4-nitrosoaniline
Property Insights of N,N-diethyl-4-nitrosoaniline
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-diethyl-4-nitrosoaniline. With a topological polar surface area (TPSA) of 32.7 Ų, N,N-diethyl-4-nitrosoaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-diethyl-4-nitrosoaniline has 0 hydrogen bond donor(s) and 3 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-diethyl-4-nitrosoaniline?
The CAS number of N,N-diethyl-4-nitrosoaniline is 120-22-9.
What is the molecular formula of N,N-diethyl-4-nitrosoaniline?
The molecular formula of N,N-diethyl-4-nitrosoaniline is C10H14N2O.
What is the molecular weight of N,N-diethyl-4-nitrosoaniline?
The molecular weight of N,N-diethyl-4-nitrosoaniline is 178.11 g/mol.
Where can I buy N,N-diethyl-4-nitrosoaniline?
You can request a quote for N,N-diethyl-4-nitrosoaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-diethyl-4-nitrosoaniline?
Yes, KEHONG BIO provides custom synthesis services for N,N-diethyl-4-nitrosoaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.