Benzyl 5-bromo-2-hydroxybenzoate
TL;DR: Benzyl 5-bromo-2-hydroxybenzoate (CAS 56529-67-0) is a chemical compound with molecular formula C14H11BrO3 and molecular weight 305.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 5-bromo-2-hydroxybenzoate
Also Known As: benzyl 5-bromo-2-hydroxybenzoate, Benzyl5-bromo-2-hydroxybenzoate, 5-bromo-2-hydroxybenzoic acid (phenylmethyl) ester, I14-5656
| Molecular Formula | C14H11BrO3 |
|---|---|
| Molecular Weight | 305.99 g/mol |
| LogP | 3.5117 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 305.98917 |
| Heavy Atoms | 18 |
| Complexity | 552.2205 |
Chemical Identifiers
| CAS Number | 56529-67-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)C2=C(C=CC(=C2)Br)O |
Product Overview
Benzyl 5-bromo-2-hydroxybenzoate (CAS 56529-67-0), with molecular formula C14H11BrO3 and molecular weight 305.99 g/mol. IUPAC: benzyl 5-bromo-2-hydroxybenzoate.
Chemical Property Profile of Benzyl 5-bromo-2-hydroxybenzoate
Property Insights of Benzyl 5-bromo-2-hydroxybenzoate
The XLogP value of 3.5117 indicates that Benzyl 5-bromo-2-hydroxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.53 Ų, Benzyl 5-bromo-2-hydroxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl 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 Benzyl 5-bromo-2-hydroxybenzoate?
The CAS number of Benzyl 5-bromo-2-hydroxybenzoate is 56529-67-0.
What is the molecular formula of Benzyl 5-bromo-2-hydroxybenzoate?
The molecular formula of Benzyl 5-bromo-2-hydroxybenzoate is C14H11BrO3.
What is the molecular weight of Benzyl 5-bromo-2-hydroxybenzoate?
The molecular weight of Benzyl 5-bromo-2-hydroxybenzoate is 305.99 g/mol.
Where can I buy Benzyl 5-bromo-2-hydroxybenzoate?
You can request a quote for Benzyl 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 Benzyl 5-bromo-2-hydroxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl 5-bromo-2-hydroxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.