1,2,3-Cyclopentatrione, 1,3-dioxime
TL;DR: 1,2,3-Cyclopentatrione, 1,3-dioxime (CAS 27894-44-6) is a chemical compound with molecular formula C5H6N2O3 and molecular weight 142.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E,5E)-2,5-bis(hydroxyimino)cyclopentan-1-one
Also Known As: 2,5-Dioximino cyclopentanone, 2,5-Bis cyclopentan-1-one, 1,2,3-Cyclopentatrione, 1,3-dioxime, 1,2,3-cyclopentanetrione-1,3-dioxime, 1,2,3-Cyclopentanetrione, 1,3-dioxime
| Molecular Formula | C5H6N2O3 |
|---|---|
| Molecular Weight | 142.04 g/mol |
| LogP | 0.0097 |
| Topological Polar Surface Area | 82.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 142.03784 |
| Heavy Atoms | 10 |
| Complexity | 196.93295 |
Chemical Identifiers
| CAS Number | 27894-44-6 |
|---|---|
| SMILES | C1/C(=N\O)/C(=O)/C(=N/O)/C1 |
Product Overview
1,2,3-Cyclopentatrione, 1,3-dioxime (CAS 27894-44-6), with molecular formula C5H6N2O3 and molecular weight 142.04 g/mol. IUPAC: (2E,5E)-2,5-bis(hydroxyimino)cyclopentan-1-one.
Chemical Property Profile of 1,2,3-Cyclopentatrione, 1,3-dioxime
Property Insights of 1,2,3-Cyclopentatrione, 1,3-dioxime
The XLogP value of 0.0097 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,3-Cyclopentatrione, 1,3-dioxime. The TPSA of 82.25 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,3-Cyclopentatrione, 1,3-dioxime. Following Lipinski's Rule of Five, 1,2,3-Cyclopentatrione, 1,3-dioxime has 2 hydrogen bond donor(s) and 5 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 1,2,3-Cyclopentatrione, 1,3-dioxime?
The CAS number of 1,2,3-Cyclopentatrione, 1,3-dioxime is 27894-44-6.
What is the molecular formula of 1,2,3-Cyclopentatrione, 1,3-dioxime?
The molecular formula of 1,2,3-Cyclopentatrione, 1,3-dioxime is C5H6N2O3.
What is the molecular weight of 1,2,3-Cyclopentatrione, 1,3-dioxime?
The molecular weight of 1,2,3-Cyclopentatrione, 1,3-dioxime is 142.04 g/mol.
Where can I buy 1,2,3-Cyclopentatrione, 1,3-dioxime?
You can request a quote for 1,2,3-Cyclopentatrione, 1,3-dioxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3-Cyclopentatrione, 1,3-dioxime?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3-Cyclopentatrione, 1,3-dioxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.