4'-Nitrobiphenyl-4-carboxaldehyde
TL;DR: 4'-Nitrobiphenyl-4-carboxaldehyde (CAS 98648-23-8) is a chemical compound with molecular formula C13H9NO3 and molecular weight 227.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-nitrophenyl)benzaldehyde
Also Known As: 4'-Nitro-[1,1'-biphenyl]-4-carbaldehyde, 4-(4-nitrophenyl)benzaldehyde, 4-Formyl-4'-nitrobiphenyl, 4'-Nitro-[1,1'-biphenyl]-4-carboxaldehyde, 4'-Nitrobiphenyl-4-carboxaldehyde
| Molecular Formula | C13H9NO3 |
|---|---|
| Molecular Weight | 227.06 g/mol |
| LogP | 3.0743 |
| Topological Polar Surface Area | 60.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 227.05824 |
| Heavy Atoms | 17 |
| Complexity | 543.8822 |
Chemical Identifiers
| CAS Number | 98648-23-8 |
|---|---|
| SMILES | C1=CC(=CC=C1C=O)C2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
4'-Nitrobiphenyl-4-carboxaldehyde (CAS 98648-23-8), with molecular formula C13H9NO3 and molecular weight 227.06 g/mol. IUPAC: 4-(4-nitrophenyl)benzaldehyde.
Chemical Property Profile of 4'-Nitrobiphenyl-4-carboxaldehyde
Property Insights of 4'-Nitrobiphenyl-4-carboxaldehyde
The XLogP value of 3.0743 indicates that 4'-Nitrobiphenyl-4-carboxaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 4'-Nitrobiphenyl-4-carboxaldehyde. Following Lipinski's Rule of Five, 4'-Nitrobiphenyl-4-carboxaldehyde has 0 hydrogen bond donor(s) and 3 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'-Nitrobiphenyl-4-carboxaldehyde?
The CAS number of 4'-Nitrobiphenyl-4-carboxaldehyde is 98648-23-8.
What is the molecular formula of 4'-Nitrobiphenyl-4-carboxaldehyde?
The molecular formula of 4'-Nitrobiphenyl-4-carboxaldehyde is C13H9NO3.
What is the molecular weight of 4'-Nitrobiphenyl-4-carboxaldehyde?
The molecular weight of 4'-Nitrobiphenyl-4-carboxaldehyde is 227.06 g/mol.
Where can I buy 4'-Nitrobiphenyl-4-carboxaldehyde?
You can request a quote for 4'-Nitrobiphenyl-4-carboxaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-Nitrobiphenyl-4-carboxaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4'-Nitrobiphenyl-4-carboxaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.