1,4-Benzenediamine, dioctyl-
TL;DR: 1,4-Benzenediamine, dioctyl- (CAS 88520-97-2) is a chemical compound with molecular formula C22H40N2 and molecular weight 332.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dioctylbenzene-1,4-diamine
Also Known As: 1,4-Benzenediamine, dioctyl-, 2,3-dioctylbenzene-1,4-diamine, RefChem:219982
| Molecular Formula | C22H40N2 |
|---|---|
| Molecular Weight | 332.32 g/mol |
| LogP | 8.7 |
| Topological Polar Surface Area | 52.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 14 |
| Exact Mass | 332.31915 |
| Heavy Atoms | 24 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 88520-97-2 |
|---|---|
| SMILES | CCCCCCCCC1=C(C=CC(=C1CCCCCCCC)N)N |
| InChIKey | NYKPMDFDQLCJRT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Benzenediamine, dioctyl- (CAS 88520-97-2), with molecular formula C22H40N2 and molecular weight 332.32 g/mol. IUPAC: 2,3-dioctylbenzene-1,4-diamine.
Chemical Property Profile of 1,4-Benzenediamine, dioctyl-
Property Insights of 1,4-Benzenediamine, dioctyl-
The XLogP value of 8.7 indicates that 1,4-Benzenediamine, dioctyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.0 Ų, 1,4-Benzenediamine, dioctyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Benzenediamine, dioctyl- has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,4-Benzenediamine, dioctyl-?
The CAS number of 1,4-Benzenediamine, dioctyl- is 88520-97-2.
What is the molecular formula of 1,4-Benzenediamine, dioctyl-?
The molecular formula of 1,4-Benzenediamine, dioctyl- is C22H40N2.
What is the molecular weight of 1,4-Benzenediamine, dioctyl-?
The molecular weight of 1,4-Benzenediamine, dioctyl- is 332.32 g/mol.
Where can I buy 1,4-Benzenediamine, dioctyl-?
You can request a quote for 1,4-Benzenediamine, dioctyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Benzenediamine, dioctyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Benzenediamine, dioctyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.