3-Nitro-4-phenoxybenzaldehyde
TL;DR: 3-Nitro-4-phenoxybenzaldehyde (CAS 148776-17-4) is a chemical compound with molecular formula C13H9NO4 and molecular weight 243.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-nitro-4-phenoxybenzaldehyde
Also Known As: 3-nitro-4-phenoxybenzaldehyde, Benzaldehyde, 3-nitro-4-phenoxy-, 3-nitro-4-phenoxy-benzaldehyde
| Molecular Formula | C13H9NO4 |
|---|---|
| Molecular Weight | 243.05 g/mol |
| LogP | 3.1996 |
| Topological Polar Surface Area | 69.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 243.05316 |
| Heavy Atoms | 18 |
| Complexity | 580.80005 |
Chemical Identifiers
| CAS Number | 148776-17-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC2=C(C=C(C=C2)C=O)[N+](=O)[O-] |
Product Overview
3-Nitro-4-phenoxybenzaldehyde (CAS 148776-17-4), with molecular formula C13H9NO4 and molecular weight 243.05 g/mol. IUPAC: 3-nitro-4-phenoxybenzaldehyde.
Chemical Property Profile of 3-Nitro-4-phenoxybenzaldehyde
Property Insights of 3-Nitro-4-phenoxybenzaldehyde
The XLogP value of 3.1996 indicates that 3-Nitro-4-phenoxybenzaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Nitro-4-phenoxybenzaldehyde. Following Lipinski's Rule of Five, 3-Nitro-4-phenoxybenzaldehyde 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 3-Nitro-4-phenoxybenzaldehyde?
The CAS number of 3-Nitro-4-phenoxybenzaldehyde is 148776-17-4.
What is the molecular formula of 3-Nitro-4-phenoxybenzaldehyde?
The molecular formula of 3-Nitro-4-phenoxybenzaldehyde is C13H9NO4.
What is the molecular weight of 3-Nitro-4-phenoxybenzaldehyde?
The molecular weight of 3-Nitro-4-phenoxybenzaldehyde is 243.05 g/mol.
Where can I buy 3-Nitro-4-phenoxybenzaldehyde?
You can request a quote for 3-Nitro-4-phenoxybenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Nitro-4-phenoxybenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-Nitro-4-phenoxybenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.