5-Benzyl-2-hydroxy-3-nitrobenzaldehyde
TL;DR: 5-Benzyl-2-hydroxy-3-nitrobenzaldehyde (CAS 328565-16-8) is a chemical compound with molecular formula C14H11NO4 and molecular weight 257.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-benzyl-2-hydroxy-3-nitrobenzaldehyde
Also Known As: Col003, 5-benzyl-2-hydroxy-3-nitrobenzaldehyde, 5-benzyl-2-hydroxy-3-nitro-benzaldehyde, Col 003, EX-A13147
| Molecular Formula | C14H11NO4 |
|---|---|
| Molecular Weight | 257.07 g/mol |
| LogP | 2.7037 |
| Topological Polar Surface Area | 80.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 257.06882 |
| Heavy Atoms | 19 |
| Complexity | 622.84314 |
Chemical Identifiers
| CAS Number | 328565-16-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2=CC(=C(C(=C2)[N+](=O)[O-])O)C=O |
Product Overview
5-Benzyl-2-hydroxy-3-nitrobenzaldehyde (CAS 328565-16-8), with molecular formula C14H11NO4 and molecular weight 257.07 g/mol. IUPAC: 5-benzyl-2-hydroxy-3-nitrobenzaldehyde.
Chemical Property Profile of 5-Benzyl-2-hydroxy-3-nitrobenzaldehyde
Property Insights of 5-Benzyl-2-hydroxy-3-nitrobenzaldehyde
The XLogP value of 2.7037 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Benzyl-2-hydroxy-3-nitrobenzaldehyde. The TPSA of 80.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Benzyl-2-hydroxy-3-nitrobenzaldehyde. Following Lipinski's Rule of Five, 5-Benzyl-2-hydroxy-3-nitrobenzaldehyde 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 5-Benzyl-2-hydroxy-3-nitrobenzaldehyde?
The CAS number of 5-Benzyl-2-hydroxy-3-nitrobenzaldehyde is 328565-16-8.
What is the molecular formula of 5-Benzyl-2-hydroxy-3-nitrobenzaldehyde?
The molecular formula of 5-Benzyl-2-hydroxy-3-nitrobenzaldehyde is C14H11NO4.
What is the molecular weight of 5-Benzyl-2-hydroxy-3-nitrobenzaldehyde?
The molecular weight of 5-Benzyl-2-hydroxy-3-nitrobenzaldehyde is 257.07 g/mol.
Where can I buy 5-Benzyl-2-hydroxy-3-nitrobenzaldehyde?
You can request a quote for 5-Benzyl-2-hydroxy-3-nitrobenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Benzyl-2-hydroxy-3-nitrobenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 5-Benzyl-2-hydroxy-3-nitrobenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.