3,5-Di-tert-butylaniline
TL;DR: 3,5-Di-tert-butylaniline (CAS 2380-36-1) is a chemical compound with molecular formula C14H23N and molecular weight 205.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-ditert-butylaniline
Also Known As: 3,5-Di-tert-butylaniline, 3,5-ditert-butylaniline, 3,5-di-t-butylaniline, 3,5-ditert-butylphenylamine, 3,5-Bis(tert-butyl)aniline
| Molecular Formula | C14H23N |
|---|---|
| Molecular Weight | 205.18 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 205.18304 |
| Heavy Atoms | 15 |
| Complexity | 184.0 |
Chemical Identifiers
| CAS Number | 2380-36-1 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=CC(=C1)N)C(C)(C)C |
| InChIKey | MJKNHXCPGXUEDO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,5-Di-tert-butylaniline (CAS 2380-36-1), with molecular formula C14H23N and molecular weight 205.18 g/mol. IUPAC: 3,5-ditert-butylaniline.
Chemical Property Profile of 3,5-Di-tert-butylaniline
Property Insights of 3,5-Di-tert-butylaniline
The XLogP value of 4.6 indicates that 3,5-Di-tert-butylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.0 Ų, 3,5-Di-tert-butylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Di-tert-butylaniline has 1 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 3,5-Di-tert-butylaniline?
The CAS number of 3,5-Di-tert-butylaniline is 2380-36-1.
What is the molecular formula of 3,5-Di-tert-butylaniline?
The molecular formula of 3,5-Di-tert-butylaniline is C14H23N.
What is the molecular weight of 3,5-Di-tert-butylaniline?
The molecular weight of 3,5-Di-tert-butylaniline is 205.18 g/mol.
Where can I buy 3,5-Di-tert-butylaniline?
You can request a quote for 3,5-Di-tert-butylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Di-tert-butylaniline?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Di-tert-butylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.