(3-Nitrophenyl)methyl 4-formylbenzoate
TL;DR: (3-Nitrophenyl)methyl 4-formylbenzoate (CAS 722486-53-5) is a chemical compound with molecular formula C15H11NO5 and molecular weight 285.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-nitrophenyl)methyl 4-formylbenzoate
Also Known As: (3-nitrophenyl)methyl 4-formylbenzoate
| Molecular Formula | C15H11NO5 |
|---|---|
| Molecular Weight | 285.06 g/mol |
| LogP | 2.7643 |
| Topological Polar Surface Area | 86.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 285.06372 |
| Heavy Atoms | 21 |
| Complexity | 678.71826 |
Chemical Identifiers
| CAS Number | 722486-53-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])COC(=O)C2=CC=C(C=C2)C=O |
Product Overview
(3-Nitrophenyl)methyl 4-formylbenzoate (CAS 722486-53-5), with molecular formula C15H11NO5 and molecular weight 285.06 g/mol. IUPAC: (3-nitrophenyl)methyl 4-formylbenzoate.
Chemical Property Profile of (3-Nitrophenyl)methyl 4-formylbenzoate
Property Insights of (3-Nitrophenyl)methyl 4-formylbenzoate
The XLogP value of 2.7643 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3-Nitrophenyl)methyl 4-formylbenzoate. The TPSA of 86.51 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-Nitrophenyl)methyl 4-formylbenzoate. Following Lipinski's Rule of Five, (3-Nitrophenyl)methyl 4-formylbenzoate has 0 hydrogen bond donor(s) and 5 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-Nitrophenyl)methyl 4-formylbenzoate?
The CAS number of (3-Nitrophenyl)methyl 4-formylbenzoate is 722486-53-5.
What is the molecular formula of (3-Nitrophenyl)methyl 4-formylbenzoate?
The molecular formula of (3-Nitrophenyl)methyl 4-formylbenzoate is C15H11NO5.
What is the molecular weight of (3-Nitrophenyl)methyl 4-formylbenzoate?
The molecular weight of (3-Nitrophenyl)methyl 4-formylbenzoate is 285.06 g/mol.
Where can I buy (3-Nitrophenyl)methyl 4-formylbenzoate?
You can request a quote for (3-Nitrophenyl)methyl 4-formylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Nitrophenyl)methyl 4-formylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for (3-Nitrophenyl)methyl 4-formylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.