3-氨基-2-萘甲酸
TL;DR: 3-氨基-2-萘甲酸 (CAS 5959-52-4) is a chemical compound with molecular formula C11H9NO2 and molecular weight 187.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-氨基-2-萘甲酸
3-aminonaphthalene-2-carboxylic acid
Also Known As: 3-AMINO-2-NAPHTHOIC ACID, 3-aminonaphthalene-2-carboxylic acid, 2-Amino-3-naphthoic acid, 3-Aminoisonaphthoic acid, 2-Amino-3-carboxynaphthalene
| Molecular Formula | C11H9NO2 |
|---|---|
| Molecular Weight | 187.06 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 187.06332 |
| Heavy Atoms | 14 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 5959-52-4 |
|---|---|
| SMILES | C1=CC=C2C=C(C(=CC2=C1)C(=O)O)N |
| InChIKey | XFXOLBNQYFRSLQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-氨基-2-萘甲酸 (CAS 5959-52-4), with molecular formula C11H9NO2 and molecular weight 187.06 g/mol. IUPAC: 3-aminonaphthalene-2-carboxylic acid.
Chemical Property Profile of 3-氨基-2-萘甲酸
Property Insights of 3-氨基-2-萘甲酸
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-氨基-2-萘甲酸. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-氨基-2-萘甲酸. Following Lipinski's Rule of Five, 3-氨基-2-萘甲酸 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 3-氨基-2-萘甲酸?
The CAS number of 3-氨基-2-萘甲酸 is 5959-52-4.
What is the molecular formula of 3-氨基-2-萘甲酸?
The molecular formula of 3-氨基-2-萘甲酸 is C11H9NO2.
What is the molecular weight of 3-氨基-2-萘甲酸?
The molecular weight of 3-氨基-2-萘甲酸 is 187.06 g/mol.
Where can I buy 3-氨基-2-萘甲酸?
You can request a quote for 3-氨基-2-萘甲酸 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-2-萘甲酸?
Yes, KEHONG BIO provides custom synthesis services for 3-氨基-2-萘甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.