5-Chloro-2-hydroxy-3-nitrobenzoic acid
TL;DR: 5-Chloro-2-hydroxy-3-nitrobenzoic acid (CAS 7195-78-0) is a chemical compound with molecular formula C7H4ClNO5 and molecular weight 216.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-2-hydroxy-3-nitrobenzoic acid
Also Known As: 5-chloro-2-hydroxy-3-nitrobenzoic acid, 3-Nitro-5-chlorsalizylsaure, 5-Chloro-3-nitrosalicylic acid, Benzoic acid, 5-chloro-2-hydroxy-3-nitro-, LABOTEST-BB LT00452353
| Molecular Formula | C7H4ClNO5 |
|---|---|
| Molecular Weight | 216.98 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 216.9778 |
| Heavy Atoms | 14 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 7195-78-0 |
|---|---|
| SMILES | C1=C(C=C(C(=C1C(=O)O)O)[N+](=O)[O-])Cl |
| InChIKey | SIYGNKVPVGTIHB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Chloro-2-hydroxy-3-nitrobenzoic acid (CAS 7195-78-0), with molecular formula C7H4ClNO5 and molecular weight 216.98 g/mol. IUPAC: 5-chloro-2-hydroxy-3-nitrobenzoic acid.
Chemical Property Profile of 5-Chloro-2-hydroxy-3-nitrobenzoic acid
Property Insights of 5-Chloro-2-hydroxy-3-nitrobenzoic acid
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chloro-2-hydroxy-3-nitrobenzoic acid. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Chloro-2-hydroxy-3-nitrobenzoic acid. Following Lipinski's Rule of Five, 5-Chloro-2-hydroxy-3-nitrobenzoic acid has 2 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 5-Chloro-2-hydroxy-3-nitrobenzoic acid?
The CAS number of 5-Chloro-2-hydroxy-3-nitrobenzoic acid is 7195-78-0.
What is the molecular formula of 5-Chloro-2-hydroxy-3-nitrobenzoic acid?
The molecular formula of 5-Chloro-2-hydroxy-3-nitrobenzoic acid is C7H4ClNO5.
What is the molecular weight of 5-Chloro-2-hydroxy-3-nitrobenzoic acid?
The molecular weight of 5-Chloro-2-hydroxy-3-nitrobenzoic acid is 216.98 g/mol.
Where can I buy 5-Chloro-2-hydroxy-3-nitrobenzoic acid?
You can request a quote for 5-Chloro-2-hydroxy-3-nitrobenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-2-hydroxy-3-nitrobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-2-hydroxy-3-nitrobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.