N,N'-二仲丁基对苯二胺
TL;DR: N,N'-二仲丁基对苯二胺 (CAS 101-96-2) is a chemical compound with molecular formula C14H24N2 and molecular weight 220.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N'-二仲丁基对苯二胺
1-N,4-N-di(butan-2-yl)benzene-1,4-diamine
Also Known As: Antioxidant 22, N,N'-Di-sec-butyl-p-phenylenediamine, Tenamene 2, Topanol M, Kerobit BPD
| Molecular Formula | C14H24N2 |
|---|---|
| Molecular Weight | 220.19 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 24.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 220.19395 |
| Heavy Atoms | 16 |
| Complexity | 154.0 |
| Melting Point | 17.8 °C |
| Boiling Point | 98 °C @ 26.6 Pa |
| Density | 0.94 to 0.95 at 23.9 °C |
| Solubility | less than 1 mg/mL at 68 °F (NTP, 1992) |
| Flash Point | 140.6 °C |
| Vapor Pressure | 85.3 mmHg at 37.8 °C |
Chemical Identifiers
| CAS Number | 101-96-2 |
|---|---|
| SMILES | CCC(C)NC1=CC=C(C=C1)NC(C)CC |
| InChIKey | FSWDLYNGJBGFJH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N'-二仲丁基对苯二胺 (CAS 101-96-2), with molecular formula C14H24N2 and molecular weight 220.19 g/mol. IUPAC: 1-N,4-N-di(butan-2-yl)benzene-1,4-diamine.
Chemical Property Profile of N,N'-二仲丁基对苯二胺
Property Insights of N,N'-二仲丁基对苯二胺
The XLogP value of 4.5 indicates that N,N'-二仲丁基对苯二胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.1 Ų, N,N'-二仲丁基对苯二胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N'-二仲丁基对苯二胺 has 2 hydrogen bond donor(s) and 2 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 N,N'-二仲丁基对苯二胺?
The CAS number of N,N'-二仲丁基对苯二胺 is 101-96-2.
What is the molecular formula of N,N'-二仲丁基对苯二胺?
The molecular formula of N,N'-二仲丁基对苯二胺 is C14H24N2.
What is the molecular weight of N,N'-二仲丁基对苯二胺?
The molecular weight of N,N'-二仲丁基对苯二胺 is 220.19 g/mol.
Where can I buy N,N'-二仲丁基对苯二胺?
You can request a quote for N,N'-二仲丁基对苯二胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N'-二仲丁基对苯二胺?
Yes, KEHONG BIO provides custom synthesis services for N,N'-二仲丁基对苯二胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.