3-nitro-N,N-diphenylaniline
TL;DR: 3-nitro-N,N-diphenylaniline (CAS 100148-35-4) is a chemical compound with molecular formula C18H14N2O2 and molecular weight 290.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-nitro-N,N-diphenylaniline
Also Known As: 3-nitro-N,N-diphenylaniline, NCIOpen2_007114, (3-nitro-phenyl)-diphenyl-amine
| Molecular Formula | C18H14N2O2 |
|---|---|
| Molecular Weight | 290.11 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 49.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 290.10553 |
| Heavy Atoms | 22 |
| Complexity | 339.0 |
Chemical Identifiers
| CAS Number | 100148-35-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-] |
| InChIKey | RPOZPZAEUYGBDA-UHFFFAOYSA-N |
Product Overview
3-nitro-N,N-diphenylaniline (CAS 100148-35-4), with molecular formula C18H14N2O2 and molecular weight 290.11 g/mol. IUPAC: 3-nitro-N,N-diphenylaniline.
Chemical Property Profile of 3-nitro-N,N-diphenylaniline
Property Insights of 3-nitro-N,N-diphenylaniline
The XLogP value of 5.3 indicates that 3-nitro-N,N-diphenylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.1 Ų, 3-nitro-N,N-diphenylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-nitro-N,N-diphenylaniline has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-nitro-N,N-diphenylaniline?
The CAS number of 3-nitro-N,N-diphenylaniline is 100148-35-4.
What is the molecular formula of 3-nitro-N,N-diphenylaniline?
The molecular formula of 3-nitro-N,N-diphenylaniline is C18H14N2O2.
What is the molecular weight of 3-nitro-N,N-diphenylaniline?
The molecular weight of 3-nitro-N,N-diphenylaniline is 290.11 g/mol.
Where can I buy 3-nitro-N,N-diphenylaniline?
You can request a quote for 3-nitro-N,N-diphenylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-nitro-N,N-diphenylaniline?
Yes, KEHONG BIO provides custom synthesis services for 3-nitro-N,N-diphenylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.