3-氨基-5-硝基水杨酸
TL;DR: 3-氨基-5-硝基水杨酸 (CAS 831-51-6) is a chemical compound with molecular formula C7H6N2O5 and molecular weight 198.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-氨基-5-硝基水杨酸
3-amino-2-hydroxy-5-nitrobenzoic acid
Also Known As: 3-Amino-5-nitrosalicylic acid, 3-Amino-2-hydroxy-5-nitrobenzoic acid, 3-amino-5-nitrosalicylicacid, EINECS 212-602-2, Benzoic acid, 3-amino-2-hydroxy-5-nitro-
| Molecular Formula | C7H6N2O5 |
|---|---|
| Molecular Weight | 198.03 g/mol |
| LogP | 0.5808 |
| Topological Polar Surface Area | 126.69 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 198.02766 |
| Heavy Atoms | 14 |
| Complexity | 414.78635 |
Chemical Identifiers
| CAS Number | 831-51-6 |
|---|---|
| SMILES | C1=C(C=C(C(=C1C(=O)O)O)N)[N+](=O)[O-] |
Product Overview
3-氨基-5-硝基水杨酸 (CAS 831-51-6), with molecular formula C7H6N2O5 and molecular weight 198.03 g/mol. IUPAC: 3-amino-2-hydroxy-5-nitrobenzoic acid.
Chemical Property Profile of 3-氨基-5-硝基水杨酸
Property Insights of 3-氨基-5-硝基水杨酸
The XLogP value of 0.5808 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-氨基-5-硝基水杨酸. The TPSA of 126.69 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-氨基-5-硝基水杨酸. Following Lipinski's Rule of Five, 3-氨基-5-硝基水杨酸 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-氨基-5-硝基水杨酸?
The CAS number of 3-氨基-5-硝基水杨酸 is 831-51-6.
What is the molecular formula of 3-氨基-5-硝基水杨酸?
The molecular formula of 3-氨基-5-硝基水杨酸 is C7H6N2O5.
What is the molecular weight of 3-氨基-5-硝基水杨酸?
The molecular weight of 3-氨基-5-硝基水杨酸 is 198.03 g/mol.
Where can I buy 3-氨基-5-硝基水杨酸?
You can request a quote for 3-氨基-5-硝基水杨酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-氨基-5-硝基水杨酸?
Yes, KEHONG BIO provides custom synthesis services for 3-氨基-5-硝基水杨酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.