(6E)-6-[(2,4-dichloroanilino)methylidene]-4-nitrocyclohexa-2,4-dien-1-one
TL;DR: (6E)-6-[(2,4-dichloroanilino)methylidene]-4-nitrocyclohexa-2,4-dien-1-one (CAS 5375-40-6) is a chemical compound with molecular formula C13H8Cl2N2O3 and molecular weight 309.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2,4-dichlorophenyl)iminomethyl]-4-nitrophenol
Also Known As: 2-{[(2,4-dichlorophenyl)imino]methyl}-4-nitrophenol, 2-{(E)-[(2,4-dichlorophenyl)imino]methyl}-4-nitrophenol, (6E)-6-[(2,4-dichloroanilino)methylidene]-4-nitrocyclohexa-2,4-dien-1-one, 2-((2,4-DICHLORO-PHENYLIMINO)-METHYL)-4-NITRO-PHENOL, 2-[(1E)-2-(2,4-dichlorophenyl)-2-azavinyl]-4-nitrophenol
| Molecular Formula | C13H8Cl2N2O3 |
|---|---|
| Molecular Weight | 309.99 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 78.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 309.9912 |
| Heavy Atoms | 20 |
| Complexity | 375.0 |
Chemical Identifiers
| CAS Number | 5375-40-6 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])C=NC2=C(C=C(C=C2)Cl)Cl)O |
| InChIKey | KXCWXFMRPXZNMY-UHFFFAOYSA-N |
Product Overview
(6E)-6-[(2,4-dichloroanilino)methylidene]-4-nitrocyclohexa-2,4-dien-1-one (CAS 5375-40-6), with molecular formula C13H8Cl2N2O3 and molecular weight 309.99 g/mol. IUPAC: 2-[(2,4-dichlorophenyl)iminomethyl]-4-nitrophenol.
Chemical Property Profile of (6E)-6-[(2,4-dichloroanilino)methylidene]-4-nitrocyclohexa-2,4-dien-1-one
Property Insights of (6E)-6-[(2,4-dichloroanilino)methylidene]-4-nitrocyclohexa-2,4-dien-1-one
The XLogP value of 4.0 indicates that (6E)-6-[(2,4-dichloroanilino)methylidene]-4-nitrocyclohexa-2,4-dien-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (6E)-6-[(2,4-dichloroanilino)methylidene]-4-nitrocyclohexa-2,4-dien-1-one. Following Lipinski's Rule of Five, (6E)-6-[(2,4-dichloroanilino)methylidene]-4-nitrocyclohexa-2,4-dien-1-one has 1 hydrogen bond donor(s) and 4 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 (6E)-6-[(2,4-dichloroanilino)methylidene]-4-nitrocyclohexa-2,4-dien-1-one?
The CAS number of (6E)-6-[(2,4-dichloroanilino)methylidene]-4-nitrocyclohexa-2,4-dien-1-one is 5375-40-6.
What is the molecular formula of (6E)-6-[(2,4-dichloroanilino)methylidene]-4-nitrocyclohexa-2,4-dien-1-one?
The molecular formula of (6E)-6-[(2,4-dichloroanilino)methylidene]-4-nitrocyclohexa-2,4-dien-1-one is C13H8Cl2N2O3.
What is the molecular weight of (6E)-6-[(2,4-dichloroanilino)methylidene]-4-nitrocyclohexa-2,4-dien-1-one?
The molecular weight of (6E)-6-[(2,4-dichloroanilino)methylidene]-4-nitrocyclohexa-2,4-dien-1-one is 309.99 g/mol.
Where can I buy (6E)-6-[(2,4-dichloroanilino)methylidene]-4-nitrocyclohexa-2,4-dien-1-one?
You can request a quote for (6E)-6-[(2,4-dichloroanilino)methylidene]-4-nitrocyclohexa-2,4-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 (6E)-6-[(2,4-dichloroanilino)methylidene]-4-nitrocyclohexa-2,4-dien-1-one?
Yes, KEHONG BIO provides custom synthesis services for (6E)-6-[(2,4-dichloroanilino)methylidene]-4-nitrocyclohexa-2,4-dien-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.