TL;DR: N,N'-bis[1-isopropyl-2-methylpropyl]ethylenediamine (CAS 58789-70-1) is a chemical compound with molecular formula C16H36N2 and molecular weight 256.28784 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N'-bis(2,4-dimethylpentan-3-yl)ethane-1,2-diamine
Also Known As: N,N'-bis[1-isopropyl-2-methylpropyl]ethylenediamine, n,n'-bis(2,4-dimethylpentan-3-yl)ethane-1,2-diamine, N,N'-Bis(1-isopropyl-2-methylpropyl)ethylenediamine, N,N'-Bis(2-methyl-1-isopropylpropyl)-1,2-ethanediamine, N,N -Bis(2-methyl-1-isopropylpropyl)-1,2-ethanediamine
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C16H36N2 |
| Molecular Weight | 256.28784 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 24.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 256.28784 Da |
| Heavy Atoms | 18 |
| Complexity | 159.0 |
| SMILES | CC(C)C(C(C)C)NCCNC(C(C)C)C(C)C |
| InChIKey | AJVWVTSSZWIPPZ-UHFFFAOYSA-N |
The XLogP value of 4.8 indicates that N,N'-bis[1-isopropyl-2-methylpropyl]ethylenediamine 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'-bis[1-isopropyl-2-methylpropyl]ethylenediamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N'-bis[1-isopropyl-2-methylpropyl]ethylenediamine has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N,N'-bis[1-isopropyl-2-methylpropyl]ethylenediamine is 58789-70-1.
The molecular formula of N,N'-bis[1-isopropyl-2-methylpropyl]ethylenediamine is C16H36N2.
The molecular weight of N,N'-bis[1-isopropyl-2-methylpropyl]ethylenediamine is 256.28784 g/mol.
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