3,3-Dimorpholin-4-ylpentane-2,4-dione
TL;DR: 3,3-Dimorpholin-4-ylpentane-2,4-dione (CAS 55591-44-1) is a chemical compound with molecular formula C13H22N2O4 and molecular weight 270.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimorpholin-4-ylpentane-2,4-dione
Also Known As: 3,3-dimorpholin-4-ylpentane-2,4-dione, 3,3-dimorpholinopentane-2,4-dione, 3,3-di(morpholin-4-yl)pentane-2,4-dione
| Molecular Formula | C13H22N2O4 |
|---|---|
| Molecular Weight | 270.16 g/mol |
| LogP | -0.4749 |
| Topological Polar Surface Area | 59.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 270.15796 |
| Heavy Atoms | 19 |
| Complexity | 312.55237 |
Chemical Identifiers
| CAS Number | 55591-44-1 |
|---|---|
| SMILES | CC(=O)C(C(=O)C)(N1CCOCC1)N2CCOCC2 |
Product Overview
3,3-Dimorpholin-4-ylpentane-2,4-dione (CAS 55591-44-1), with molecular formula C13H22N2O4 and molecular weight 270.16 g/mol. IUPAC: 3,3-dimorpholin-4-ylpentane-2,4-dione.
Chemical Property Profile of 3,3-Dimorpholin-4-ylpentane-2,4-dione
Property Insights of 3,3-Dimorpholin-4-ylpentane-2,4-dione
The XLogP value of -0.4749 indicates that 3,3-Dimorpholin-4-ylpentane-2,4-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 59.08 Ų, 3,3-Dimorpholin-4-ylpentane-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Dimorpholin-4-ylpentane-2,4-dione has 0 hydrogen bond donor(s) and 6 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 3,3-Dimorpholin-4-ylpentane-2,4-dione?
The CAS number of 3,3-Dimorpholin-4-ylpentane-2,4-dione is 55591-44-1.
What is the molecular formula of 3,3-Dimorpholin-4-ylpentane-2,4-dione?
The molecular formula of 3,3-Dimorpholin-4-ylpentane-2,4-dione is C13H22N2O4.
What is the molecular weight of 3,3-Dimorpholin-4-ylpentane-2,4-dione?
The molecular weight of 3,3-Dimorpholin-4-ylpentane-2,4-dione is 270.16 g/mol.
Where can I buy 3,3-Dimorpholin-4-ylpentane-2,4-dione?
You can request a quote for 3,3-Dimorpholin-4-ylpentane-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Dimorpholin-4-ylpentane-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Dimorpholin-4-ylpentane-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.