2-Hydroxy-5-nitrobenzyl bromide
TL;DR: 2-Hydroxy-5-nitrobenzyl bromide (CAS 772-33-8) is a chemical compound with molecular formula C7H6BrNO3 and molecular weight 230.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(bromomethyl)-4-nitrophenol
Also Known As: 2-(Bromomethyl)-4-nitrophenol, 2-HYDROXY-5-NITROBENZYL BROMIDE, alpha-Bromo-4-nitro-o-cresol, Koshland I, Lumiflavine
| Molecular Formula | C7H6BrNO3 |
|---|---|
| Molecular Weight | 230.95 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 66.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 230.95311 |
| Heavy Atoms | 12 |
| Complexity | 171.0 |
Chemical Identifiers
| CAS Number | 772-33-8 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])CBr)O |
| InChIKey | KFDPCYZHENQOBV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Hydroxy-5-nitrobenzyl bromide (CAS 772-33-8), with molecular formula C7H6BrNO3 and molecular weight 230.95 g/mol. IUPAC: 2-(bromomethyl)-4-nitrophenol.
Chemical Property Profile of 2-Hydroxy-5-nitrobenzyl bromide
Property Insights of 2-Hydroxy-5-nitrobenzyl bromide
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hydroxy-5-nitrobenzyl bromide. The TPSA of 66.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Hydroxy-5-nitrobenzyl bromide. Following Lipinski's Rule of Five, 2-Hydroxy-5-nitrobenzyl bromide 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 2-Hydroxy-5-nitrobenzyl bromide?
The CAS number of 2-Hydroxy-5-nitrobenzyl bromide is 772-33-8.
What is the molecular formula of 2-Hydroxy-5-nitrobenzyl bromide?
The molecular formula of 2-Hydroxy-5-nitrobenzyl bromide is C7H6BrNO3.
What is the molecular weight of 2-Hydroxy-5-nitrobenzyl bromide?
The molecular weight of 2-Hydroxy-5-nitrobenzyl bromide is 230.95 g/mol.
Where can I buy 2-Hydroxy-5-nitrobenzyl bromide?
You can request a quote for 2-Hydroxy-5-nitrobenzyl bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxy-5-nitrobenzyl bromide?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxy-5-nitrobenzyl bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.