2-(5-Methyl-3,4-dinitropyrazol-1-yl)-1-morpholin-4-ylethanone
TL;DR: 2-(5-Methyl-3,4-dinitropyrazol-1-yl)-1-morpholin-4-ylethanone (CAS 353455-15-9) is a chemical compound with molecular formula C10H13N5O6 and molecular weight 299.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-methyl-3,4-dinitropyrazol-1-yl)-1-morpholin-4-ylethanone
Also Known As: BAS 00398082, BIM-0027641.P001, 2-(5-methyl-3,4-dinitropyrazol-1-yl)-1-morpholin-4-ylethanone, 4-({3,4-bisnitro-5-methyl-1H-pyrazol-1-yl}acetyl)morpholine, 2-(5-methyl-3,4-dinitro-1H-pyrazol-1-yl)-1-morpholinoethanone
| Molecular Formula | C10H13N5O6 |
|---|---|
| Molecular Weight | 299.09 g/mol |
| LogP | -0.13328 |
| Topological Polar Surface Area | 133.64 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 299.08658 |
| Heavy Atoms | 21 |
| Complexity | 591.0039 |
Chemical Identifiers
| CAS Number | 353455-15-9 |
|---|---|
| SMILES | CC1=C(C(=NN1CC(=O)N2CCOCC2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
2-(5-Methyl-3,4-dinitropyrazol-1-yl)-1-morpholin-4-ylethanone (CAS 353455-15-9), with molecular formula C10H13N5O6 and molecular weight 299.09 g/mol. IUPAC: 2-(5-methyl-3,4-dinitropyrazol-1-yl)-1-morpholin-4-ylethanone.
Chemical Property Profile of 2-(5-Methyl-3,4-dinitropyrazol-1-yl)-1-morpholin-4-ylethanone
Property Insights of 2-(5-Methyl-3,4-dinitropyrazol-1-yl)-1-morpholin-4-ylethanone
The XLogP value of -0.13328 indicates that 2-(5-Methyl-3,4-dinitropyrazol-1-yl)-1-morpholin-4-ylethanone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 133.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(5-Methyl-3,4-dinitropyrazol-1-yl)-1-morpholin-4-ylethanone. Following Lipinski's Rule of Five, 2-(5-Methyl-3,4-dinitropyrazol-1-yl)-1-morpholin-4-ylethanone has 0 hydrogen bond donor(s) and 7 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 2-(5-Methyl-3,4-dinitropyrazol-1-yl)-1-morpholin-4-ylethanone?
The CAS number of 2-(5-Methyl-3,4-dinitropyrazol-1-yl)-1-morpholin-4-ylethanone is 353455-15-9.
What is the molecular formula of 2-(5-Methyl-3,4-dinitropyrazol-1-yl)-1-morpholin-4-ylethanone?
The molecular formula of 2-(5-Methyl-3,4-dinitropyrazol-1-yl)-1-morpholin-4-ylethanone is C10H13N5O6.
What is the molecular weight of 2-(5-Methyl-3,4-dinitropyrazol-1-yl)-1-morpholin-4-ylethanone?
The molecular weight of 2-(5-Methyl-3,4-dinitropyrazol-1-yl)-1-morpholin-4-ylethanone is 299.09 g/mol.
Where can I buy 2-(5-Methyl-3,4-dinitropyrazol-1-yl)-1-morpholin-4-ylethanone?
You can request a quote for 2-(5-Methyl-3,4-dinitropyrazol-1-yl)-1-morpholin-4-ylethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(5-Methyl-3,4-dinitropyrazol-1-yl)-1-morpholin-4-ylethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(5-Methyl-3,4-dinitropyrazol-1-yl)-1-morpholin-4-ylethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.