4-[(3-Nitrophenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one
TL;DR: 4-[(3-Nitrophenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one (CAS 2011-53-2) is a chemical compound with molecular formula C12H9N3O3 and molecular weight 243.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3-nitrophenyl)diazenyl]phenol
Also Known As: 4-[2-(3-Nitrophenyl)diazen-1-yl]phenol, 3 -Nitroazobenzene-4-ol, 3-nitro-4'-hydroxyazobenzene, 4-[(3-nitrophenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one, J3.481.416C
| Molecular Formula | C12H9N3O3 |
|---|---|
| Molecular Weight | 243.06 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 90.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 243.06439 |
| Heavy Atoms | 18 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 2011-53-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])N=NC2=CC=C(C=C2)O |
| InChIKey | SLYQPPRDXYMFGP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-[(3-Nitrophenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one (CAS 2011-53-2), with molecular formula C12H9N3O3 and molecular weight 243.06 g/mol. IUPAC: 4-[(3-nitrophenyl)diazenyl]phenol.
Chemical Property Profile of 4-[(3-Nitrophenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one
Property Insights of 4-[(3-Nitrophenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one
The XLogP value of 3.5 indicates that 4-[(3-Nitrophenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(3-Nitrophenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one. Following Lipinski's Rule of Five, 4-[(3-Nitrophenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one has 1 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 4-[(3-Nitrophenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one?
The CAS number of 4-[(3-Nitrophenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one is 2011-53-2.
What is the molecular formula of 4-[(3-Nitrophenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one?
The molecular formula of 4-[(3-Nitrophenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one is C12H9N3O3.
What is the molecular weight of 4-[(3-Nitrophenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one?
The molecular weight of 4-[(3-Nitrophenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one is 243.06 g/mol.
Where can I buy 4-[(3-Nitrophenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one?
You can request a quote for 4-[(3-Nitrophenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(3-Nitrophenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one?
Yes, KEHONG BIO provides custom synthesis services for 4-[(3-Nitrophenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.