2-((5-Chloro-pyridin-2-ylimino)-methyl)-4-nitro-phenol
TL;DR: 2-((5-Chloro-pyridin-2-ylimino)-methyl)-4-nitro-phenol (CAS 329936-96-1) is a chemical compound with molecular formula C12H8ClN3O3 and molecular weight 277.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-chloro-2-pyridinyl)iminomethyl]-4-nitrophenol
Also Known As: (E)-2-(((5-chloropyridin-2-yl)imino)methyl)-4-nitrophenol, 2-[(1E)-2-(5-chloro(2-pyridyl))-2-azavinyl]-4-nitrophenol, 2-{(E)-[(5-chloropyridin-2-yl)imino]methyl}-4-nitrophenol, 2-((5-CHLORO-PYRIDIN-2-YLIMINO)-METHYL)-4-NITRO-PHENOL, (6Z)-6-[[(5-chloropyridin-2-yl)amino]methylidene]-4-nitrocyclohexa-2,4-dien-1-one
| Molecular Formula | C12H8ClN3O3 |
|---|---|
| Molecular Weight | 277.03 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 91.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 277.02542 |
| Heavy Atoms | 19 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 329936-96-1 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])C=NC2=NC=C(C=C2)Cl)O |
| InChIKey | TXSOKRWHYVPNSM-UHFFFAOYSA-N |
Product Overview
2-((5-Chloro-pyridin-2-ylimino)-methyl)-4-nitro-phenol (CAS 329936-96-1), with molecular formula C12H8ClN3O3 and molecular weight 277.03 g/mol. IUPAC: 2-[(5-chloro-2-pyridinyl)iminomethyl]-4-nitrophenol.
Chemical Property Profile of 2-((5-Chloro-pyridin-2-ylimino)-methyl)-4-nitro-phenol
Property Insights of 2-((5-Chloro-pyridin-2-ylimino)-methyl)-4-nitro-phenol
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((5-Chloro-pyridin-2-ylimino)-methyl)-4-nitro-phenol. The TPSA of 91.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((5-Chloro-pyridin-2-ylimino)-methyl)-4-nitro-phenol. Following Lipinski's Rule of Five, 2-((5-Chloro-pyridin-2-ylimino)-methyl)-4-nitro-phenol 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 2-((5-Chloro-pyridin-2-ylimino)-methyl)-4-nitro-phenol?
The CAS number of 2-((5-Chloro-pyridin-2-ylimino)-methyl)-4-nitro-phenol is 329936-96-1.
What is the molecular formula of 2-((5-Chloro-pyridin-2-ylimino)-methyl)-4-nitro-phenol?
The molecular formula of 2-((5-Chloro-pyridin-2-ylimino)-methyl)-4-nitro-phenol is C12H8ClN3O3.
What is the molecular weight of 2-((5-Chloro-pyridin-2-ylimino)-methyl)-4-nitro-phenol?
The molecular weight of 2-((5-Chloro-pyridin-2-ylimino)-methyl)-4-nitro-phenol is 277.03 g/mol.
Where can I buy 2-((5-Chloro-pyridin-2-ylimino)-methyl)-4-nitro-phenol?
You can request a quote for 2-((5-Chloro-pyridin-2-ylimino)-methyl)-4-nitro-phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((5-Chloro-pyridin-2-ylimino)-methyl)-4-nitro-phenol?
Yes, KEHONG BIO provides custom synthesis services for 2-((5-Chloro-pyridin-2-ylimino)-methyl)-4-nitro-phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.