4-Nitrophenyl formate
TL;DR: 4-Nitrophenyl formate (CAS 1865-01-6) is a chemical compound with molecular formula C7H5NO4 and molecular weight 167.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-nitrophenyl) formate
Also Known As: 4-Nitrophenyl formate, p-Nitrophenyl formate, (4-nitrophenyl) formate, 4-nitrophenylformate, Formic acid, 4-nitrophenyl ester
| Molecular Formula | C7H5NO4 |
|---|---|
| Molecular Weight | 167.02 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 167.02185 |
| Heavy Atoms | 12 |
| Complexity | 169.0 |
Chemical Identifiers
| CAS Number | 1865-01-6 |
|---|---|
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])OC=O |
| InChIKey | IEXRKQFZXJSHOB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Nitrophenyl formate (CAS 1865-01-6), with molecular formula C7H5NO4 and molecular weight 167.02 g/mol. IUPAC: (4-nitrophenyl) formate.
Chemical Property Profile of 4-Nitrophenyl formate
Property Insights of 4-Nitrophenyl formate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Nitrophenyl formate. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Nitrophenyl formate. Following Lipinski's Rule of Five, 4-Nitrophenyl formate 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-Nitrophenyl formate?
The CAS number of 4-Nitrophenyl formate is 1865-01-6.
What is the molecular formula of 4-Nitrophenyl formate?
The molecular formula of 4-Nitrophenyl formate is C7H5NO4.
What is the molecular weight of 4-Nitrophenyl formate?
The molecular weight of 4-Nitrophenyl formate is 167.02 g/mol.
Where can I buy 4-Nitrophenyl formate?
You can request a quote for 4-Nitrophenyl formate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Nitrophenyl formate?
Yes, KEHONG BIO provides custom synthesis services for 4-Nitrophenyl formate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.