4-(Benzyloxy)-3-nitrobenzaldehyde
TL;DR: 4-(Benzyloxy)-3-nitrobenzaldehyde (CAS 22955-07-3) 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.
3-nitro-4-phenylmethoxybenzaldehyde
Also Known As: 4-(benzyloxy)-3-nitrobenzaldehyde, 4-Benzyloxy-3-nitrobenzaldehyde, 3-nitro-4-phenylmethoxybenzaldehyde, 4-benzyloxy-3-nitro-benzaldehyde, 4-(Benzyloxy)-3-nitrobenzaldehyd
| Molecular Formula | C14H11NO4 |
|---|---|
| Molecular Weight | 257.07 g/mol |
| LogP | 2.9863 |
| Topological Polar Surface Area | 69.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 257.06882 |
| Heavy Atoms | 19 |
| Complexity | 595.6499 |
Chemical Identifiers
| CAS Number | 22955-07-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=C(C=C(C=C2)C=O)[N+](=O)[O-] |
Product Overview
4-(Benzyloxy)-3-nitrobenzaldehyde (CAS 22955-07-3), with molecular formula C14H11NO4 and molecular weight 257.07 g/mol. IUPAC: 3-nitro-4-phenylmethoxybenzaldehyde.
Chemical Property Profile of 4-(Benzyloxy)-3-nitrobenzaldehyde
Property Insights of 4-(Benzyloxy)-3-nitrobenzaldehyde
The XLogP value of 2.9863 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Benzyloxy)-3-nitrobenzaldehyde. The TPSA of 69.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Benzyloxy)-3-nitrobenzaldehyde. Following Lipinski's Rule of Five, 4-(Benzyloxy)-3-nitrobenzaldehyde has 0 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 4-(Benzyloxy)-3-nitrobenzaldehyde?
The CAS number of 4-(Benzyloxy)-3-nitrobenzaldehyde is 22955-07-3.
What is the molecular formula of 4-(Benzyloxy)-3-nitrobenzaldehyde?
The molecular formula of 4-(Benzyloxy)-3-nitrobenzaldehyde is C14H11NO4.
What is the molecular weight of 4-(Benzyloxy)-3-nitrobenzaldehyde?
The molecular weight of 4-(Benzyloxy)-3-nitrobenzaldehyde is 257.07 g/mol.
Where can I buy 4-(Benzyloxy)-3-nitrobenzaldehyde?
You can request a quote for 4-(Benzyloxy)-3-nitrobenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Benzyloxy)-3-nitrobenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-(Benzyloxy)-3-nitrobenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.