3,5-Dimethyl-4-((4-nitrophenoxy)imino)cyclohexa-2,5-dienone
TL;DR: 3,5-Dimethyl-4-((4-nitrophenoxy)imino)cyclohexa-2,5-dienone (CAS 392248-89-4) is a chemical compound with molecular formula C14H12N2O4 and molecular weight 272.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dimethyl-4-(4-nitrophenoxy)iminocyclohexa-2,5-dien-1-one
Also Known As: 3,5-dimethyl-4-[(4-nitrophenoxy)imino]cyclohexa-2,5-dien-1-one, AB00578273-02, 3,5-dimethyl-4-((4-nitrophenoxy)imino)cyclohexa-2,5-dienone, 3,5-dimethyl-4-(4-nitrophenoxy)iminocyclohexa-2,5-dien-1-one, F0355-0043
| Molecular Formula | C14H12N2O4 |
|---|---|
| Molecular Weight | 272.08 g/mol |
| LogP | 2.8049 |
| Topological Polar Surface Area | 81.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 272.0797 |
| Heavy Atoms | 20 |
| Complexity | 630.2564 |
Chemical Identifiers
| CAS Number | 392248-89-4 |
|---|---|
| SMILES | CC1=CC(=O)C=C(C1=NOC2=CC=C(C=C2)[N+](=O)[O-])C |
Product Overview
3,5-Dimethyl-4-((4-nitrophenoxy)imino)cyclohexa-2,5-dienone (CAS 392248-89-4), with molecular formula C14H12N2O4 and molecular weight 272.08 g/mol. IUPAC: 3,5-dimethyl-4-(4-nitrophenoxy)iminocyclohexa-2,5-dien-1-one.
Chemical Property Profile of 3,5-Dimethyl-4-((4-nitrophenoxy)imino)cyclohexa-2,5-dienone
Property Insights of 3,5-Dimethyl-4-((4-nitrophenoxy)imino)cyclohexa-2,5-dienone
The XLogP value of 2.8049 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Dimethyl-4-((4-nitrophenoxy)imino)cyclohexa-2,5-dienone. The TPSA of 81.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Dimethyl-4-((4-nitrophenoxy)imino)cyclohexa-2,5-dienone. Following Lipinski's Rule of Five, 3,5-Dimethyl-4-((4-nitrophenoxy)imino)cyclohexa-2,5-dienone has 0 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 3,5-Dimethyl-4-((4-nitrophenoxy)imino)cyclohexa-2,5-dienone?
The CAS number of 3,5-Dimethyl-4-((4-nitrophenoxy)imino)cyclohexa-2,5-dienone is 392248-89-4.
What is the molecular formula of 3,5-Dimethyl-4-((4-nitrophenoxy)imino)cyclohexa-2,5-dienone?
The molecular formula of 3,5-Dimethyl-4-((4-nitrophenoxy)imino)cyclohexa-2,5-dienone is C14H12N2O4.
What is the molecular weight of 3,5-Dimethyl-4-((4-nitrophenoxy)imino)cyclohexa-2,5-dienone?
The molecular weight of 3,5-Dimethyl-4-((4-nitrophenoxy)imino)cyclohexa-2,5-dienone is 272.08 g/mol.
Where can I buy 3,5-Dimethyl-4-((4-nitrophenoxy)imino)cyclohexa-2,5-dienone?
You can request a quote for 3,5-Dimethyl-4-((4-nitrophenoxy)imino)cyclohexa-2,5-dienone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dimethyl-4-((4-nitrophenoxy)imino)cyclohexa-2,5-dienone?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dimethyl-4-((4-nitrophenoxy)imino)cyclohexa-2,5-dienone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.