对硝基苯甲醛 O-(间硝基苄基)肟
TL;DR: 对硝基苯甲醛 O-(间硝基苄基)肟 (CAS 33215-60-0) is a chemical compound with molecular formula C14H11N3O5 and molecular weight 301.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
对硝基苯甲醛 O-(间硝基苄基)肟
1-(4-nitrophenyl)-N-[(3-nitrophenyl)methoxy]methanimine
Also Known As: p-Nitrobenzaldehyde O-(m-nitrobenzyl)oxime, 1-(4-nitrophenyl)-N-[(3-nitrophenyl)methoxy]methanimine, (E)-1-(4-nitrophenyl)-N-[(3-nitrophenyl)methoxy]methanimine
| Molecular Formula | C14H11N3O5 |
|---|---|
| Molecular Weight | 301.07 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 301.0699 |
| Heavy Atoms | 22 |
| Complexity | 410.0 |
Chemical Identifiers
| CAS Number | 33215-60-0 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])CON=CC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | YAPIGDWFNPNBAO-UHFFFAOYSA-N |
Product Overview
对硝基苯甲醛 O-(间硝基苄基)肟 (CAS 33215-60-0), with molecular formula C14H11N3O5 and molecular weight 301.07 g/mol. IUPAC: 1-(4-nitrophenyl)-N-[(3-nitrophenyl)methoxy]methanimine.
Chemical Property Profile of 对硝基苯甲醛 O-(间硝基苄基)肟
Property Insights of 对硝基苯甲醛 O-(间硝基苄基)肟
The XLogP value of 3.1 indicates that 对硝基苯甲醛 O-(间硝基苄基)肟 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 对硝基苯甲醛 O-(间硝基苄基)肟. Following Lipinski's Rule of Five, 对硝基苯甲醛 O-(间硝基苄基)肟 has 0 hydrogen bond donor(s) and 6 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 对硝基苯甲醛 O-(间硝基苄基)肟?
The CAS number of 对硝基苯甲醛 O-(间硝基苄基)肟 is 33215-60-0.
What is the molecular formula of 对硝基苯甲醛 O-(间硝基苄基)肟?
The molecular formula of 对硝基苯甲醛 O-(间硝基苄基)肟 is C14H11N3O5.
What is the molecular weight of 对硝基苯甲醛 O-(间硝基苄基)肟?
The molecular weight of 对硝基苯甲醛 O-(间硝基苄基)肟 is 301.07 g/mol.
Where can I buy 对硝基苯甲醛 O-(间硝基苄基)肟?
You can request a quote for 对硝基苯甲醛 O-(间硝基苄基)肟 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 对硝基苯甲醛 O-(间硝基苄基)肟?
Yes, KEHONG BIO provides custom synthesis services for 对硝基苯甲醛 O-(间硝基苄基)肟 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.