Octamethylenediamine, N,N'-bis(o-chlorobenzyl)-, dihydrochloride
TL;DR: Octamethylenediamine, N,N'-bis(o-chlorobenzyl)-, dihydrochloride (CAS 2229-40-5) is a chemical compound with molecular formula C22H32Cl4N2 and molecular weight 464.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N'-bis[(2-chlorophenyl)methyl]octane-1,8-diamine;dihydrochloride
Also Known As: N,N'-Octamethylenebis(2-chlorobenzylamine) dihydrochloride, Octamethylenediamine, N,N'-bis(o-chlorobenzyl)-, dihydrochloride, N,N'-Bis(o-chlorobenzyl)octamethylenediamine dihydrochloride, 1,8-Octanediamine, N,N'-bis(o-chlorobenzyl)-, dihydrochloride, Benzylamine, N,N'-octamethylenebis(2-chloro-, dihydrochloride
| Molecular Formula | C22H32Cl4N2 |
|---|---|
| Molecular Weight | 464.13 g/mol |
| LogP | 7.06 |
| Topological Polar Surface Area | 24.1 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 13 |
| Exact Mass | 466.129 |
| Heavy Atoms | 28 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 2229-40-5 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CNCCCCCCCCNCC2=CC=CC=C2Cl)Cl.Cl.Cl |
| InChIKey | VHBUILOKMFUWPN-UHFFFAOYSA-N |
Product Overview
Octamethylenediamine, N,N'-bis(o-chlorobenzyl)-, dihydrochloride (CAS 2229-40-5), with molecular formula C22H32Cl4N2 and molecular weight 464.13 g/mol. IUPAC: N,N'-bis[(2-chlorophenyl)methyl]octane-1,8-diamine;dihydrochloride.
Chemical Property Profile of Octamethylenediamine, N,N'-bis(o-chlorobenzyl)-, dihydrochloride
Property Insights of Octamethylenediamine, N,N'-bis(o-chlorobenzyl)-, dihydrochloride
The XLogP value of 7.06 indicates that Octamethylenediamine, N,N'-bis(o-chlorobenzyl)-, dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.1 Ų, Octamethylenediamine, N,N'-bis(o-chlorobenzyl)-, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octamethylenediamine, N,N'-bis(o-chlorobenzyl)-, dihydrochloride has 4 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 Octamethylenediamine, N,N'-bis(o-chlorobenzyl)-, dihydrochloride?
The CAS number of Octamethylenediamine, N,N'-bis(o-chlorobenzyl)-, dihydrochloride is 2229-40-5.
What is the molecular formula of Octamethylenediamine, N,N'-bis(o-chlorobenzyl)-, dihydrochloride?
The molecular formula of Octamethylenediamine, N,N'-bis(o-chlorobenzyl)-, dihydrochloride is C22H32Cl4N2.
What is the molecular weight of Octamethylenediamine, N,N'-bis(o-chlorobenzyl)-, dihydrochloride?
The molecular weight of Octamethylenediamine, N,N'-bis(o-chlorobenzyl)-, dihydrochloride is 464.13 g/mol.
Where can I buy Octamethylenediamine, N,N'-bis(o-chlorobenzyl)-, dihydrochloride?
You can request a quote for Octamethylenediamine, N,N'-bis(o-chlorobenzyl)-, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octamethylenediamine, N,N'-bis(o-chlorobenzyl)-, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Octamethylenediamine, N,N'-bis(o-chlorobenzyl)-, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.