1-Bromo-2-naphthoic acid
TL;DR: 1-Bromo-2-naphthoic acid (CAS 20717-79-7) is a chemical compound with molecular formula C11H7BrO2 and molecular weight 249.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromonaphthalene-2-carboxylic acid
Also Known As: 1-Bromo-2-naphthoic acid, 1-bromonaphthalene-2-carboxylic acid, 2-Naphthalenecarboxylic acid, 1-bromo-, Maybridge4_002377, 1-bromo-2-napthoic acid
| Molecular Formula | C11H7BrO2 |
|---|---|
| Molecular Weight | 249.96 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 249.96294 |
| Heavy Atoms | 14 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 20717-79-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC(=C2Br)C(=O)O |
| InChIKey | VUVIRKAVBZITDO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Bromo-2-naphthoic acid (CAS 20717-79-7), with molecular formula C11H7BrO2 and molecular weight 249.96 g/mol. IUPAC: 1-bromonaphthalene-2-carboxylic acid.
Chemical Property Profile of 1-Bromo-2-naphthoic acid
Property Insights of 1-Bromo-2-naphthoic acid
The XLogP value of 3.4 indicates that 1-Bromo-2-naphthoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 1-Bromo-2-naphthoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-2-naphthoic acid has 1 hydrogen bond donor(s) and 2 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 1-Bromo-2-naphthoic acid?
The CAS number of 1-Bromo-2-naphthoic acid is 20717-79-7.
What is the molecular formula of 1-Bromo-2-naphthoic acid?
The molecular formula of 1-Bromo-2-naphthoic acid is C11H7BrO2.
What is the molecular weight of 1-Bromo-2-naphthoic acid?
The molecular weight of 1-Bromo-2-naphthoic acid is 249.96 g/mol.
Where can I buy 1-Bromo-2-naphthoic acid?
You can request a quote for 1-Bromo-2-naphthoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromo-2-naphthoic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-2-naphthoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.