4-硝基苯甲醇
TL;DR: 4-硝基苯甲醇 (CAS 619-73-8) is a chemical compound with molecular formula C7H7NO3 and molecular weight 153.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-硝基苯甲醇
(4-nitrophenyl)methanol
Also Known As: 4-Nitrobenzyl alcohol, (4-Nitrophenyl)methanol, p-Nitrobenzyl alcohol, 4-Nitrobenzenemethanol, Benzenemethanol, 4-nitro-
| Molecular Formula | C7H7NO3 |
|---|---|
| Molecular Weight | 153.04 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 66.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 153.04259 |
| Heavy Atoms | 11 |
| Complexity | 135.0 |
| Vapor Pressure | 0.0000858 [mmHg] |
Chemical Identifiers
| CAS Number | 619-73-8 |
|---|---|
| SMILES | C1=CC(=CC=C1CO)[N+](=O)[O-] |
| InChIKey | JKTYGPATCNUWKN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-硝基苯甲醇 (CAS 619-73-8), with molecular formula C7H7NO3 and molecular weight 153.04 g/mol. IUPAC: (4-nitrophenyl)methanol.
Chemical Property Profile of 4-硝基苯甲醇
Property Insights of 4-硝基苯甲醇
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-硝基苯甲醇. The TPSA of 66.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-硝基苯甲醇. Following Lipinski's Rule of Five, 4-硝基苯甲醇 has 1 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-硝基苯甲醇?
The CAS number of 4-硝基苯甲醇 is 619-73-8.
What is the molecular formula of 4-硝基苯甲醇?
The molecular formula of 4-硝基苯甲醇 is C7H7NO3.
What is the molecular weight of 4-硝基苯甲醇?
The molecular weight of 4-硝基苯甲醇 is 153.04 g/mol.
Where can I buy 4-硝基苯甲醇?
You can request a quote for 4-硝基苯甲醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-硝基苯甲醇?
Yes, KEHONG BIO provides custom synthesis services for 4-硝基苯甲醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.