(4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-dimethanamine
TL;DR: (4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-dimethanamine (CAS 111320-77-5) 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.
[(4R,5R)-5-(aminomethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methanamine
Also Known As: J2.082.672J, (4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-dimethanamine, 1,3-Dioxolane-4,5-dimethanamine, 2,2-dimethyl-, (4R,5R)-, ((4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-diyl)dimethanamine, 2,2-Dimethyl-1,3-dioxolane-4alpha,5beta-bismethaneamine
| Molecular Formula | C7H16N2O2 |
|---|---|
| Molecular Weight | 160.12 g/mol |
| LogP | -1.3 |
| Topological Polar Surface Area | 70.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 160.12119 |
| Heavy Atoms | 11 |
| Complexity | 124.0 |
Chemical Identifiers
| CAS Number | 111320-77-5 |
|---|---|
| SMILES | CC1(O[C@@H]([C@H](O1)CN)CN)C |
| InChIKey | KQGQLRAYJUXGOW-PHDIDXHHSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-dimethanamine (CAS 111320-77-5), with molecular formula C7H16N2O2 and molecular weight 160.12 g/mol. IUPAC: [(4R,5R)-5-(aminomethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methanamine.
Chemical Property Profile of (4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-dimethanamine
Property Insights of (4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-dimethanamine
The XLogP value of -1.3 indicates that (4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-dimethanamine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 70.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-dimethanamine. Following Lipinski's Rule of Five, (4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-dimethanamine 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 (4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-dimethanamine?
The CAS number of (4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-dimethanamine is 111320-77-5.
What is the molecular formula of (4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-dimethanamine?
The molecular formula of (4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-dimethanamine is C7H16N2O2.
What is the molecular weight of (4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-dimethanamine?
The molecular weight of (4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-dimethanamine is 160.12 g/mol.
Where can I buy (4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-dimethanamine?
You can request a quote for (4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-dimethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-dimethanamine?
Yes, KEHONG BIO provides custom synthesis services for (4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-dimethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.