4,4'-Di-tert-butyldiphenylamine
TL;DR: 4,4'-Di-tert-butyldiphenylamine (CAS 4627-22-9) is a chemical compound with molecular formula C20H27N and molecular weight 281.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-N-(4-tert-butylphenyl)aniline
Also Known As: Bis(4-tert-butylphenyl)amine, Bis(4-(tert-butyl)phenyl)amine, 4,4'-Di-tert-butyldiphenylamine, Bis(p-tert-butylphenyl)amine, 4-tert-butyl-N-(4-tert-butylphenyl)aniline
| Molecular Formula | C20H27N |
|---|---|
| Molecular Weight | 281.21 g/mol |
| LogP | 6.8 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 281.21436 |
| Heavy Atoms | 21 |
| Complexity | 272.0 |
Chemical Identifiers
| CAS Number | 4627-22-9 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)NC2=CC=C(C=C2)C(C)(C)C |
| InChIKey | OPEKHRGERHDLRK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,4'-Di-tert-butyldiphenylamine (CAS 4627-22-9), with molecular formula C20H27N and molecular weight 281.21 g/mol. IUPAC: 4-tert-butyl-N-(4-tert-butylphenyl)aniline.
Chemical Property Profile of 4,4'-Di-tert-butyldiphenylamine
Property Insights of 4,4'-Di-tert-butyldiphenylamine
The XLogP value of 6.8 indicates that 4,4'-Di-tert-butyldiphenylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, 4,4'-Di-tert-butyldiphenylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4'-Di-tert-butyldiphenylamine has 1 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 4,4'-Di-tert-butyldiphenylamine?
The CAS number of 4,4'-Di-tert-butyldiphenylamine is 4627-22-9.
What is the molecular formula of 4,4'-Di-tert-butyldiphenylamine?
The molecular formula of 4,4'-Di-tert-butyldiphenylamine is C20H27N.
What is the molecular weight of 4,4'-Di-tert-butyldiphenylamine?
The molecular weight of 4,4'-Di-tert-butyldiphenylamine is 281.21 g/mol.
Where can I buy 4,4'-Di-tert-butyldiphenylamine?
You can request a quote for 4,4'-Di-tert-butyldiphenylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-Di-tert-butyldiphenylamine?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-Di-tert-butyldiphenylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.