1,4-Benzenediamine, 2,5-diethoxy-N1-ethyl-
TL;DR: 1,4-Benzenediamine, 2,5-diethoxy-N1-ethyl- (CAS 68052-17-5) is a chemical compound with molecular formula C12H20N2O2 and molecular weight 224.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-diethoxy-1-N-ethylbenzene-1,4-diamine
Also Known As: 1,4-Benzenediamine, 2,5-diethoxy-N-ethyl-, 2,5-Diethoxy-N-ethylbenzene-1,4-diamine, N-Ethyl-2,5-diethoxy-p-phenylenediamine, 1,4-Benzenediamine, 2,5-diethoxy-N1-ethyl-, 2,5-Diethoxy-N-ethyl-1,4-benzenediamine
| Molecular Formula | C12H20N2O2 |
|---|---|
| Molecular Weight | 224.15 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 56.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 224.15248 |
| Heavy Atoms | 16 |
| Complexity | 190.0 |
Chemical Identifiers
| CAS Number | 68052-17-5 |
|---|---|
| SMILES | CCNC1=C(C=C(C(=C1)OCC)N)OCC |
| InChIKey | BTOXMNSTGQCTIZ-UHFFFAOYSA-N |
Product Overview
1,4-Benzenediamine, 2,5-diethoxy-N1-ethyl- (CAS 68052-17-5), with molecular formula C12H20N2O2 and molecular weight 224.15 g/mol. IUPAC: 2,5-diethoxy-1-N-ethylbenzene-1,4-diamine.
Chemical Property Profile of 1,4-Benzenediamine, 2,5-diethoxy-N1-ethyl-
Property Insights of 1,4-Benzenediamine, 2,5-diethoxy-N1-ethyl-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Benzenediamine, 2,5-diethoxy-N1-ethyl-. With a topological polar surface area (TPSA) of 56.5 Ų, 1,4-Benzenediamine, 2,5-diethoxy-N1-ethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Benzenediamine, 2,5-diethoxy-N1-ethyl- has 2 hydrogen bond donor(s) and 4 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 1,4-Benzenediamine, 2,5-diethoxy-N1-ethyl-?
The CAS number of 1,4-Benzenediamine, 2,5-diethoxy-N1-ethyl- is 68052-17-5.
What is the molecular formula of 1,4-Benzenediamine, 2,5-diethoxy-N1-ethyl-?
The molecular formula of 1,4-Benzenediamine, 2,5-diethoxy-N1-ethyl- is C12H20N2O2.
What is the molecular weight of 1,4-Benzenediamine, 2,5-diethoxy-N1-ethyl-?
The molecular weight of 1,4-Benzenediamine, 2,5-diethoxy-N1-ethyl- is 224.15 g/mol.
Where can I buy 1,4-Benzenediamine, 2,5-diethoxy-N1-ethyl-?
You can request a quote for 1,4-Benzenediamine, 2,5-diethoxy-N1-ethyl- 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, 2,5-diethoxy-N1-ethyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Benzenediamine, 2,5-diethoxy-N1-ethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.