2-(Difluoromethoxy)-5-nitrobenzaldehyde
TL;DR: 2-(Difluoromethoxy)-5-nitrobenzaldehyde (CAS 145742-63-8) is a chemical compound with molecular formula C8H5F2NO4 and molecular weight 217.01866 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(difluoromethoxy)-5-nitrobenzaldehyde
Also Known As: 2-(difluoromethoxy)-5-nitrobenzaldehyde, Benzaldehyde, 2-(difluoromethoxy)-5-nitro-, 2-(difluoromethoxy)-5-nitro-benzaldehyde, 969-569-9, G48554
Technical Specifications
| Molecular Formula | C8H5F2NO4 |
| Molecular Weight | 217.01866 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 217.01866 Da |
| Heavy Atoms | 15 |
| Complexity | 243.0 |
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])C=O)OC(F)F |
| InChIKey | YERTUMJMWKSDIU-UHFFFAOYSA-N |
Chemical Property Profile of 2-(Difluoromethoxy)-5-nitrobenzaldehyde
Property Insights of 2-(Difluoromethoxy)-5-nitrobenzaldehyde
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Difluoromethoxy)-5-nitrobenzaldehyde. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Difluoromethoxy)-5-nitrobenzaldehyde. Following Lipinski's Rule of Five, 2-(Difluoromethoxy)-5-nitrobenzaldehyde 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
What is the CAS number of 2-(Difluoromethoxy)-5-nitrobenzaldehyde?
The CAS number of 2-(Difluoromethoxy)-5-nitrobenzaldehyde is 145742-63-8.
What is the molecular formula of 2-(Difluoromethoxy)-5-nitrobenzaldehyde?
The molecular formula of 2-(Difluoromethoxy)-5-nitrobenzaldehyde is C8H5F2NO4.
What is the molecular weight of 2-(Difluoromethoxy)-5-nitrobenzaldehyde?
The molecular weight of 2-(Difluoromethoxy)-5-nitrobenzaldehyde is 217.01866 g/mol.
Where can I buy 2-(Difluoromethoxy)-5-nitrobenzaldehyde?
You can request a quote for 2-(Difluoromethoxy)-5-nitrobenzaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(Difluoromethoxy)-5-nitrobenzaldehyde?
Yes, CoreyChem provides custom synthesis services for 2-(Difluoromethoxy)-5-nitrobenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.