N,N-Diisopentylaniline
TL;DR: N,N-Diisopentylaniline (CAS 14426-16-5) is a chemical compound with molecular formula C16H27N and molecular weight 233.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-bis(3-methylbutyl)aniline
Also Known As: N,N-Diisopentylaniline, Diisoamylanilin, n,n-bis(3-methylbutyl)aniline, N,N-diisopentyl-aniline, N,N-Bis(3-methylbutyl)benzenamine
| Molecular Formula | C16H27N |
|---|---|
| Molecular Weight | 233.21 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 233.21436 |
| Heavy Atoms | 17 |
| Complexity | 168.0 |
Chemical Identifiers
| CAS Number | 14426-16-5 |
|---|---|
| SMILES | CC(C)CCN(CCC(C)C)C1=CC=CC=C1 |
| InChIKey | CIBZNPRJGQNSEV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N-Diisopentylaniline (CAS 14426-16-5), with molecular formula C16H27N and molecular weight 233.21 g/mol. IUPAC: N,N-bis(3-methylbutyl)aniline.
Chemical Property Profile of N,N-Diisopentylaniline
Property Insights of N,N-Diisopentylaniline
The XLogP value of 5.4 indicates that N,N-Diisopentylaniline 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-Diisopentylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Diisopentylaniline 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-Diisopentylaniline?
The CAS number of N,N-Diisopentylaniline is 14426-16-5.
What is the molecular formula of N,N-Diisopentylaniline?
The molecular formula of N,N-Diisopentylaniline is C16H27N.
What is the molecular weight of N,N-Diisopentylaniline?
The molecular weight of N,N-Diisopentylaniline is 233.21 g/mol.
Where can I buy N,N-Diisopentylaniline?
You can request a quote for N,N-Diisopentylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Diisopentylaniline?
Yes, KEHONG BIO provides custom synthesis services for N,N-Diisopentylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.