2-氨基-4-溴苯甲酸
TL;DR: 2-氨基-4-溴苯甲酸 (CAS 20776-50-5) is a chemical compound with molecular formula C7H6BrNO2 and molecular weight 214.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-氨基-4-溴苯甲酸
2-amino-4-bromobenzoic acid
Also Known As: 2-Amino-4-bromobenzoic acid, benzoic acid, 2-amino-4-bromo-, 4-Bromoanthranilic Acid, null, 2-Amino-4-bromobenzoicacid
| Molecular Formula | C7H6BrNO2 |
|---|---|
| Molecular Weight | 214.96 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 214.95819 |
| Heavy Atoms | 11 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 20776-50-5 |
|---|---|
| SMILES | C1=CC(=C(C=C1Br)N)C(=O)O |
| InChIKey | BNNICQAVXPXQAH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-氨基-4-溴苯甲酸 (CAS 20776-50-5), with molecular formula C7H6BrNO2 and molecular weight 214.96 g/mol. IUPAC: 2-amino-4-bromobenzoic acid.
Chemical Property Profile of 2-氨基-4-溴苯甲酸
Property Insights of 2-氨基-4-溴苯甲酸
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-氨基-4-溴苯甲酸. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-氨基-4-溴苯甲酸. Following Lipinski's Rule of Five, 2-氨基-4-溴苯甲酸 has 2 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-氨基-4-溴苯甲酸?
The CAS number of 2-氨基-4-溴苯甲酸 is 20776-50-5.
What is the molecular formula of 2-氨基-4-溴苯甲酸?
The molecular formula of 2-氨基-4-溴苯甲酸 is C7H6BrNO2.
What is the molecular weight of 2-氨基-4-溴苯甲酸?
The molecular weight of 2-氨基-4-溴苯甲酸 is 214.96 g/mol.
Where can I buy 2-氨基-4-溴苯甲酸?
You can request a quote for 2-氨基-4-溴苯甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-氨基-4-溴苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 2-氨基-4-溴苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.