n,n-Dibenzyl-4-bromoaniline
TL;DR: n,n-Dibenzyl-4-bromoaniline (CAS 6939-09-9) is a chemical compound with molecular formula C20H18BrN and molecular weight 351.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dibenzyl-4-bromoaniline
Also Known As: n,n-dibenzyl-4-bromoaniline, 4-bromo-N,N-dibenzylaniline, N,N-dibenzyl-4-bromobenzenamine, 4-Bromophenyldibenzylamine, N,N-Dibenzyl-p-bromoaniline
| Molecular Formula | C20H18BrN |
|---|---|
| Molecular Weight | 351.06 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 351.06226 |
| Heavy Atoms | 22 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 6939-09-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=CC=C(C=C3)Br |
| InChIKey | RSFLPIGKWXARAL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
n,n-Dibenzyl-4-bromoaniline (CAS 6939-09-9), with molecular formula C20H18BrN and molecular weight 351.06 g/mol. IUPAC: N,N-dibenzyl-4-bromoaniline.
Chemical Property Profile of n,n-Dibenzyl-4-bromoaniline
Property Insights of n,n-Dibenzyl-4-bromoaniline
The XLogP value of 5.7 indicates that n,n-Dibenzyl-4-bromoaniline 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-Dibenzyl-4-bromoaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n,n-Dibenzyl-4-bromoaniline has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of n,n-Dibenzyl-4-bromoaniline?
The CAS number of n,n-Dibenzyl-4-bromoaniline is 6939-09-9.
What is the molecular formula of n,n-Dibenzyl-4-bromoaniline?
The molecular formula of n,n-Dibenzyl-4-bromoaniline is C20H18BrN.
What is the molecular weight of n,n-Dibenzyl-4-bromoaniline?
The molecular weight of n,n-Dibenzyl-4-bromoaniline is 351.06 g/mol.
Where can I buy n,n-Dibenzyl-4-bromoaniline?
You can request a quote for n,n-Dibenzyl-4-bromoaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n,n-Dibenzyl-4-bromoaniline?
Yes, KEHONG BIO provides custom synthesis services for n,n-Dibenzyl-4-bromoaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.