[(2-Nitrophenyl)methylideneamino] 3-nitrobenzoate
TL;DR: [(2-Nitrophenyl)methylideneamino] 3-nitrobenzoate (CAS 353783-04-7) is a chemical compound with molecular formula C14H9N3O6 and molecular weight 315.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2-nitrophenyl)methylideneamino] 3-nitrobenzoate
Also Known As: 2-nitrobenzaldehyde O-{3-nitrobenzoyl}oxime, [(2-nitrophenyl)methylideneamino] 3-nitrobenzoate
| Molecular Formula | C14H9N3O6 |
|---|---|
| Molecular Weight | 315.05 g/mol |
| LogP | 2.6939 |
| Topological Polar Surface Area | 124.94 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.04913 |
| Heavy Atoms | 23 |
| Complexity | 802.60455 |
Chemical Identifiers
| CAS Number | 353783-04-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=NOC(=O)C2=CC(=CC=C2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
[(2-Nitrophenyl)methylideneamino] 3-nitrobenzoate (CAS 353783-04-7), with molecular formula C14H9N3O6 and molecular weight 315.05 g/mol. IUPAC: [(2-nitrophenyl)methylideneamino] 3-nitrobenzoate.
Chemical Property Profile of [(2-Nitrophenyl)methylideneamino] 3-nitrobenzoate
Property Insights of [(2-Nitrophenyl)methylideneamino] 3-nitrobenzoate
The XLogP value of 2.6939 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(2-Nitrophenyl)methylideneamino] 3-nitrobenzoate. The TPSA of 124.94 Ų falls within the moderate polarity range, balancing permeability and solubility for [(2-Nitrophenyl)methylideneamino] 3-nitrobenzoate. Following Lipinski's Rule of Five, [(2-Nitrophenyl)methylideneamino] 3-nitrobenzoate 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-Nitrophenyl)methylideneamino] 3-nitrobenzoate?
The CAS number of [(2-Nitrophenyl)methylideneamino] 3-nitrobenzoate is 353783-04-7.
What is the molecular formula of [(2-Nitrophenyl)methylideneamino] 3-nitrobenzoate?
The molecular formula of [(2-Nitrophenyl)methylideneamino] 3-nitrobenzoate is C14H9N3O6.
What is the molecular weight of [(2-Nitrophenyl)methylideneamino] 3-nitrobenzoate?
The molecular weight of [(2-Nitrophenyl)methylideneamino] 3-nitrobenzoate is 315.05 g/mol.
Where can I buy [(2-Nitrophenyl)methylideneamino] 3-nitrobenzoate?
You can request a quote for [(2-Nitrophenyl)methylideneamino] 3-nitrobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(2-Nitrophenyl)methylideneamino] 3-nitrobenzoate?
Yes, KEHONG BIO provides custom synthesis services for [(2-Nitrophenyl)methylideneamino] 3-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.