Ethyl 5-bromo-2-hydroxybenzoate
TL;DR: Ethyl 5-bromo-2-hydroxybenzoate (CAS 1135289-91-6) is a chemical compound with molecular formula C9H9BrO3 and molecular weight 243.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-bromo-2-hydroxybenzoate
Also Known As: ETHYL 5-BROMO-2-HYDROXYBENZOATE, ethyl 5-bromosalicylate, Ethyl-5-bromosalicylate, Ethyl 5-bromo-2-hydroxy-benzoate, 5-bromo-2-hydroxybenzoic acid ethyl ester
| Molecular Formula | C9H9BrO3 |
|---|---|
| Molecular Weight | 243.97 g/mol |
| LogP | 2.3314 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 243.97351 |
| Heavy Atoms | 13 |
| Complexity | 322.6359 |
Chemical Identifiers
| CAS Number | 1135289-91-6 |
|---|---|
| SMILES | CCOC(=O)C1=C(C=CC(=C1)Br)O |
Product Overview
Ethyl 5-bromo-2-hydroxybenzoate (CAS 1135289-91-6), with molecular formula C9H9BrO3 and molecular weight 243.97 g/mol. IUPAC: ethyl 5-bromo-2-hydroxybenzoate.
Chemical Property Profile of Ethyl 5-bromo-2-hydroxybenzoate
Property Insights of Ethyl 5-bromo-2-hydroxybenzoate
The XLogP value of 2.3314 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 5-bromo-2-hydroxybenzoate. With a topological polar surface area (TPSA) of 46.53 Ų, Ethyl 5-bromo-2-hydroxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 5-bromo-2-hydroxybenzoate has 1 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 Ethyl 5-bromo-2-hydroxybenzoate?
The CAS number of Ethyl 5-bromo-2-hydroxybenzoate is 1135289-91-6.
What is the molecular formula of Ethyl 5-bromo-2-hydroxybenzoate?
The molecular formula of Ethyl 5-bromo-2-hydroxybenzoate is C9H9BrO3.
What is the molecular weight of Ethyl 5-bromo-2-hydroxybenzoate?
The molecular weight of Ethyl 5-bromo-2-hydroxybenzoate is 243.97 g/mol.
Where can I buy Ethyl 5-bromo-2-hydroxybenzoate?
You can request a quote for Ethyl 5-bromo-2-hydroxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 5-bromo-2-hydroxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 5-bromo-2-hydroxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.