1,3-环己二甲胺
TL;DR: 1,3-环己二甲胺 (CAS 2579-20-6) is a chemical compound with molecular formula C8H18N2 and molecular weight 142.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-环己二甲胺
[3-(aminomethyl)cyclohexyl]methanamine
Also Known As: 1,3-Cyclohexanedimethanamine, 1,3-Bis(aminomethyl)cyclohexane, Cyclohexane-1,3-diyldimethanamine, 1,3-Cyclohexanebis(methylamine), Cyclohexanedimethanamine
| Molecular Formula | C8H18N2 |
|---|---|
| Molecular Weight | 142.15 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 52.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 142.147 |
| Heavy Atoms | 10 |
| Complexity | 83.0 |
Chemical Identifiers
| CAS Number | 2579-20-6 |
|---|---|
| SMILES | C1CC(CC(C1)CN)CN |
| InChIKey | QLBRROYTTDFLDX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-环己二甲胺 (CAS 2579-20-6), with molecular formula C8H18N2 and molecular weight 142.15 g/mol. IUPAC: [3-(aminomethyl)cyclohexyl]methanamine.
Chemical Property Profile of 1,3-环己二甲胺
Property Insights of 1,3-环己二甲胺
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-环己二甲胺. With a topological polar surface area (TPSA) of 52.0 Ų, 1,3-环己二甲胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-环己二甲胺 has 2 hydrogen bond donor(s) and 2 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-环己二甲胺?
The CAS number of 1,3-环己二甲胺 is 2579-20-6.
What is the molecular formula of 1,3-环己二甲胺?
The molecular formula of 1,3-环己二甲胺 is C8H18N2.
What is the molecular weight of 1,3-环己二甲胺?
The molecular weight of 1,3-环己二甲胺 is 142.15 g/mol.
Where can I buy 1,3-环己二甲胺?
You can request a quote for 1,3-环己二甲胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-环己二甲胺?
Yes, KEHONG BIO provides custom synthesis services for 1,3-环己二甲胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.