1,3,6-Triaminohexane
TL;DR: 1,3,6-Triaminohexane (CAS 5752-40-9) is a chemical compound with molecular formula C(CC(CCN)N)CN and molecular weight 131.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hexane-1,3,6-triamine
Also Known As: 1,3,6-Hexanetriamine, hexane-1,3,6-triamine, 1,3,6-Triaminohexane, (3-Aminopropyl) 1,3-propanediamine, RefChem:72393
| Molecular Formula | C(CC(CCN)N)CN |
|---|---|
| Molecular Weight | 131.14 g/mol |
| LogP | -1.5 |
| Topological Polar Surface Area | 78.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 131.14224 |
| Heavy Atoms | 9 |
| Complexity | 56.0 |
Chemical Identifiers
| CAS Number | 5752-40-9 |
|---|---|
| SMILES | C(CC(CCN)N)CN |
| InChIKey | AXEYWFGSQDLHDX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3,6-Triaminohexane (CAS 5752-40-9), with molecular formula C(CC(CCN)N)CN and molecular weight 131.14 g/mol. IUPAC: hexane-1,3,6-triamine.
Chemical Property Profile of 1,3,6-Triaminohexane
Property Insights of 1,3,6-Triaminohexane
The XLogP value of -1.5 indicates that 1,3,6-Triaminohexane is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 78.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,6-Triaminohexane. Following Lipinski's Rule of Five, 1,3,6-Triaminohexane 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 1,3,6-Triaminohexane?
The CAS number of 1,3,6-Triaminohexane is 5752-40-9.
What is the molecular formula of 1,3,6-Triaminohexane?
The molecular formula of 1,3,6-Triaminohexane is C(CC(CCN)N)CN.
What is the molecular weight of 1,3,6-Triaminohexane?
The molecular weight of 1,3,6-Triaminohexane is 131.14 g/mol.
Where can I buy 1,3,6-Triaminohexane?
You can request a quote for 1,3,6-Triaminohexane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,6-Triaminohexane?
Yes, KEHONG BIO provides custom synthesis services for 1,3,6-Triaminohexane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.