Methyl 2,6-diaminohexanoate
TL;DR: Methyl 2,6-diaminohexanoate (CAS 44977-95-9) is a chemical compound with molecular formula C7H16N2O2 and molecular weight 160.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2,6-diaminohexanoate
Also Known As: Methyl lysinate, methyl 2,6-diaminohexanoate, methyl L-lysinate, H-Lys-OMe, Methyl DL-lysinate
| Molecular Formula | C7H16N2O2 |
|---|---|
| Molecular Weight | 160.12 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 78.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 160.12119 |
| Heavy Atoms | 11 |
| Complexity | 117.0 |
Chemical Identifiers
| CAS Number | 44977-95-9 |
|---|---|
| SMILES | COC(=O)C(CCCCN)N |
| InChIKey | KPNBUPJZFJCCIQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 2,6-diaminohexanoate (CAS 44977-95-9), with molecular formula C7H16N2O2 and molecular weight 160.12 g/mol. IUPAC: methyl 2,6-diaminohexanoate.
Chemical Property Profile of Methyl 2,6-diaminohexanoate
Property Insights of Methyl 2,6-diaminohexanoate
The XLogP value of -0.6 indicates that Methyl 2,6-diaminohexanoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 78.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2,6-diaminohexanoate. Following Lipinski's Rule of Five, Methyl 2,6-diaminohexanoate has 2 hydrogen bond donor(s) and 4 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 Methyl 2,6-diaminohexanoate?
The CAS number of Methyl 2,6-diaminohexanoate is 44977-95-9.
What is the molecular formula of Methyl 2,6-diaminohexanoate?
The molecular formula of Methyl 2,6-diaminohexanoate is C7H16N2O2.
What is the molecular weight of Methyl 2,6-diaminohexanoate?
The molecular weight of Methyl 2,6-diaminohexanoate is 160.12 g/mol.
Where can I buy Methyl 2,6-diaminohexanoate?
You can request a quote for Methyl 2,6-diaminohexanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2,6-diaminohexanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2,6-diaminohexanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.