2-Amino-4-nitrobenzyl alcohol
TL;DR: 2-Amino-4-nitrobenzyl alcohol (CAS 78468-34-5) is a chemical compound with molecular formula C7H8N2O3 and molecular weight 168.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-amino-4-nitrophenyl)methanol
Also Known As: 2-AMINO-4-NITROBENZENEMETHANOL, 2-Amino-4-nitrobenzyl alcohol, (2-amino-4-nitrophenyl)methanol, Tiliroside, (2-Amino-4-nitro-phenyl)methanol
| Molecular Formula | C7H8N2O3 |
|---|---|
| Molecular Weight | 168.05 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 92.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 168.0535 |
| Heavy Atoms | 12 |
| Complexity | 169.0 |
Chemical Identifiers
| CAS Number | 78468-34-5 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])N)CO |
| InChIKey | NFOINKSCQYECSI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Amino-4-nitrobenzyl alcohol (CAS 78468-34-5), with molecular formula C7H8N2O3 and molecular weight 168.05 g/mol. IUPAC: (2-amino-4-nitrophenyl)methanol.
Chemical Property Profile of 2-Amino-4-nitrobenzyl alcohol
Property Insights of 2-Amino-4-nitrobenzyl alcohol
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Amino-4-nitrobenzyl alcohol. The TPSA of 92.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-4-nitrobenzyl alcohol. Following Lipinski's Rule of Five, 2-Amino-4-nitrobenzyl alcohol has 2 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 2-Amino-4-nitrobenzyl alcohol?
The CAS number of 2-Amino-4-nitrobenzyl alcohol is 78468-34-5.
What is the molecular formula of 2-Amino-4-nitrobenzyl alcohol?
The molecular formula of 2-Amino-4-nitrobenzyl alcohol is C7H8N2O3.
What is the molecular weight of 2-Amino-4-nitrobenzyl alcohol?
The molecular weight of 2-Amino-4-nitrobenzyl alcohol is 168.05 g/mol.
Where can I buy 2-Amino-4-nitrobenzyl alcohol?
You can request a quote for 2-Amino-4-nitrobenzyl alcohol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-4-nitrobenzyl alcohol?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-4-nitrobenzyl alcohol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.