3-Amino-5-nitrobenzeneboronic acid
TL;DR: 3-Amino-5-nitrobenzeneboronic acid (CAS 89466-05-7) is a chemical compound with molecular formula C6H7BN2O4 and molecular weight 182.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-amino-5-nitrophenyl)boronic acid
Also Known As: (3-amino-5-nitrophenyl)boronic acid, 3-Amino-5-nitrophenylboronic acid, 3-Amino-5-nitrobenzeneboronic acid, 3-Amino-5-nitrophenyl boronic acid, 3-BORONO-5-NITROANILINE
| Molecular Formula | C6H7BN2O4 |
|---|---|
| Molecular Weight | 182.05 g/mol |
| LogP | -1.1432 |
| Topological Polar Surface Area | 109.62 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 182.04988 |
| Heavy Atoms | 13 |
| Complexity | 341.4062 |
Chemical Identifiers
| CAS Number | 89466-05-7 |
|---|---|
| SMILES | B(C1=CC(=CC(=C1)[N+](=O)[O-])N)(O)O |
Product Overview
3-Amino-5-nitrobenzeneboronic acid (CAS 89466-05-7), with molecular formula C6H7BN2O4 and molecular weight 182.05 g/mol. IUPAC: (3-amino-5-nitrophenyl)boronic acid.
Chemical Property Profile of 3-Amino-5-nitrobenzeneboronic acid
Property Insights of 3-Amino-5-nitrobenzeneboronic acid
The XLogP value of -1.1432 indicates that 3-Amino-5-nitrobenzeneboronic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 109.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Amino-5-nitrobenzeneboronic acid. Following Lipinski's Rule of Five, 3-Amino-5-nitrobenzeneboronic acid has 3 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-Amino-5-nitrobenzeneboronic acid?
The CAS number of 3-Amino-5-nitrobenzeneboronic acid is 89466-05-7.
What is the molecular formula of 3-Amino-5-nitrobenzeneboronic acid?
The molecular formula of 3-Amino-5-nitrobenzeneboronic acid is C6H7BN2O4.
What is the molecular weight of 3-Amino-5-nitrobenzeneboronic acid?
The molecular weight of 3-Amino-5-nitrobenzeneboronic acid is 182.05 g/mol.
Where can I buy 3-Amino-5-nitrobenzeneboronic acid?
You can request a quote for 3-Amino-5-nitrobenzeneboronic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-5-nitrobenzeneboronic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-5-nitrobenzeneboronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.