1,6-Hexanediamine, N,N-diethyl-N'-(6-methylbiphenyl-3-yl)-, dioxalate, hydrate
TL;DR: 1,6-Hexanediamine, N,N-diethyl-N'-(6-methylbiphenyl-3-yl)-, dioxalate, hydrate (CAS 20092-25-5) is a chemical compound with molecular formula C27H38N2O8 and molecular weight 518.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-[6-[(4-methyl-3-phenylphenyl)azaniumyl]hexyl]azanium;bis(2-hydroxy-2-oxoacetate)
Also Known As: Aniline, N-(6-diethylaminohexyl)-4-methyl-3-phenyl-, dioxalate, monohydrate, N-(6-Diethylaminohexyl)-3-phenyl-4-methylaniline di-oxalate monohydrate, 1,6-HEXANEDIAMINE, N,N-DIETHYL-N'-(6-METHYLBIPHENYL-3-YL)-, DIOXALATE, HYDRATE, diethyl-[6-[(4-methyl-3-phenylphenyl)azaniumyl]hexyl]azanium; 2-hydroxy-2-oxoacetate, RefChem:221592
| Molecular Formula | C27H38N2O8 |
|---|---|
| Molecular Weight | 518.26 g/mol |
| LogP | -1.02 |
| Topological Polar Surface Area | 176.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 518.2628 |
| Heavy Atoms | 37 |
| Complexity | 398.0 |
Chemical Identifiers
| CAS Number | 20092-25-5 |
|---|---|
| SMILES | CC[NH+](CC)CCCCCC[NH2+]C1=CC(=C(C=C1)C)C2=CC=CC=C2.C(=O)(C(=O)[O-])O.C(=O)(C(=O)[O-])O |
| InChIKey | CBRXGLFZPZJXNR-UHFFFAOYSA-N |
Product Overview
1,6-Hexanediamine, N,N-diethyl-N'-(6-methylbiphenyl-3-yl)-, dioxalate, hydrate (CAS 20092-25-5), with molecular formula C27H38N2O8 and molecular weight 518.26 g/mol. IUPAC: diethyl-[6-[(4-methyl-3-phenylphenyl)azaniumyl]hexyl]azanium;bis(2-hydroxy-2-oxoacetate).
Chemical Property Profile of 1,6-Hexanediamine, N,N-diethyl-N'-(6-methylbiphenyl-3-yl)-, dioxalate, hydrate
Property Insights of 1,6-Hexanediamine, N,N-diethyl-N'-(6-methylbiphenyl-3-yl)-, dioxalate, hydrate
The XLogP value of -1.02 indicates that 1,6-Hexanediamine, N,N-diethyl-N'-(6-methylbiphenyl-3-yl)-, dioxalate, hydrate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 176.0 Ų indicates high polarity, suggesting 1,6-Hexanediamine, N,N-diethyl-N'-(6-methylbiphenyl-3-yl)-, dioxalate, hydrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,6-Hexanediamine, N,N-diethyl-N'-(6-methylbiphenyl-3-yl)-, dioxalate, hydrate has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,6-Hexanediamine, N,N-diethyl-N'-(6-methylbiphenyl-3-yl)-, dioxalate, hydrate?
The CAS number of 1,6-Hexanediamine, N,N-diethyl-N'-(6-methylbiphenyl-3-yl)-, dioxalate, hydrate is 20092-25-5.
What is the molecular formula of 1,6-Hexanediamine, N,N-diethyl-N'-(6-methylbiphenyl-3-yl)-, dioxalate, hydrate?
The molecular formula of 1,6-Hexanediamine, N,N-diethyl-N'-(6-methylbiphenyl-3-yl)-, dioxalate, hydrate is C27H38N2O8.
What is the molecular weight of 1,6-Hexanediamine, N,N-diethyl-N'-(6-methylbiphenyl-3-yl)-, dioxalate, hydrate?
The molecular weight of 1,6-Hexanediamine, N,N-diethyl-N'-(6-methylbiphenyl-3-yl)-, dioxalate, hydrate is 518.26 g/mol.
Where can I buy 1,6-Hexanediamine, N,N-diethyl-N'-(6-methylbiphenyl-3-yl)-, dioxalate, hydrate?
You can request a quote for 1,6-Hexanediamine, N,N-diethyl-N'-(6-methylbiphenyl-3-yl)-, dioxalate, hydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,6-Hexanediamine, N,N-diethyl-N'-(6-methylbiphenyl-3-yl)-, dioxalate, hydrate?
Yes, KEHONG BIO provides custom synthesis services for 1,6-Hexanediamine, N,N-diethyl-N'-(6-methylbiphenyl-3-yl)-, dioxalate, hydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.