N~1~-(3-Aminopropyl)propane-1,3-diaminato--1,2-dichloroethanato (1/1)
TL;DR: N~1~-(3-Aminopropyl)propane-1,3-diaminato--1,2-dichloroethanato (1/1) (CAS 54867-98-0) is a chemical compound with molecular formula C8H21Cl2N3 and molecular weight 229.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(3-aminopropyl)propane-1,3-diamine;1,2-dichloroethane
Also Known As: (C6-H17-N3.C2-H4-Cl2)x-, N'-(3-aminopropyl)propane-1,3-diamine; 1,2-dichloroethane, N-(3-Aminopropyl)-1,3-propanediamine, 1,2-dichloroethane polymer, 1,3-Propanediamine, N-(3-aminopropyl)-, polymer with 1,2-dichloroethane, N~1~-(3-Aminopropyl)propane-1,3-diaminato--1,2-dichloroethanato (1/1)
| Molecular Formula | C8H21Cl2N3 |
|---|---|
| Molecular Weight | 229.11 g/mol |
| LogP | 0.7376 |
| Topological Polar Surface Area | 64.07 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 229.11125 |
| Heavy Atoms | 13 |
| Complexity | 66.40948 |
Chemical Identifiers
| CAS Number | 54867-98-0 |
|---|---|
| SMILES | C(CN)CNCCCN.C(CCl)Cl |
Product Overview
N~1~-(3-Aminopropyl)propane-1,3-diaminato--1,2-dichloroethanato (1/1) (CAS 54867-98-0), with molecular formula C8H21Cl2N3 and molecular weight 229.11 g/mol. IUPAC: N'-(3-aminopropyl)propane-1,3-diamine;1,2-dichloroethane.
Chemical Property Profile of N~1~-(3-Aminopropyl)propane-1,3-diaminato--1,2-dichloroethanato (1/1)
Property Insights of N~1~-(3-Aminopropyl)propane-1,3-diaminato--1,2-dichloroethanato (1/1)
The XLogP value of 0.7376 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N~1~-(3-Aminopropyl)propane-1,3-diaminato--1,2-dichloroethanato (1/1). The TPSA of 64.07 Ų falls within the moderate polarity range, balancing permeability and solubility for N~1~-(3-Aminopropyl)propane-1,3-diaminato--1,2-dichloroethanato (1/1). Following Lipinski's Rule of Five, N~1~-(3-Aminopropyl)propane-1,3-diaminato--1,2-dichloroethanato (1/1) has 3 hydrogen bond donor(s) and 3 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 N~1~-(3-Aminopropyl)propane-1,3-diaminato--1,2-dichloroethanato (1/1)?
The CAS number of N~1~-(3-Aminopropyl)propane-1,3-diaminato--1,2-dichloroethanato (1/1) is 54867-98-0.
What is the molecular formula of N~1~-(3-Aminopropyl)propane-1,3-diaminato--1,2-dichloroethanato (1/1)?
The molecular formula of N~1~-(3-Aminopropyl)propane-1,3-diaminato--1,2-dichloroethanato (1/1) is C8H21Cl2N3.
What is the molecular weight of N~1~-(3-Aminopropyl)propane-1,3-diaminato--1,2-dichloroethanato (1/1)?
The molecular weight of N~1~-(3-Aminopropyl)propane-1,3-diaminato--1,2-dichloroethanato (1/1) is 229.11 g/mol.
Where can I buy N~1~-(3-Aminopropyl)propane-1,3-diaminato--1,2-dichloroethanato (1/1)?
You can request a quote for N~1~-(3-Aminopropyl)propane-1,3-diaminato--1,2-dichloroethanato (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N~1~-(3-Aminopropyl)propane-1,3-diaminato--1,2-dichloroethanato (1/1)?
Yes, KEHONG BIO provides custom synthesis services for N~1~-(3-Aminopropyl)propane-1,3-diaminato--1,2-dichloroethanato (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.