Methyl 5-bromo-2-hydroxy-3-iodobenzoate
TL;DR: Methyl 5-bromo-2-hydroxy-3-iodobenzoate (CAS 18071-51-7) is a chemical compound with molecular formula C8H6BrIO3 and molecular weight 355.85 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-bromo-2-hydroxy-3-iodobenzoate
Also Known As: methyl 5-bromo-2-hydroxy-3-iodobenzoate, methyl 5-bromo-2-hydroxy-3-iodobenzenecarboxylate, methyl 3-iodo-5-bromosalicylate, methylbromohydroxyiodobenzenecarboxylate, methyl5-bromo-2-hydroxy-3-iodobenzoate
| Molecular Formula | C8H6BrIO3 |
|---|---|
| Molecular Weight | 355.85 g/mol |
| LogP | 2.5459 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 355.8545 |
| Heavy Atoms | 13 |
| Complexity | 351.48752 |
Chemical Identifiers
| CAS Number | 18071-51-7 |
|---|---|
| SMILES | COC(=O)C1=C(C(=CC(=C1)Br)I)O |
Product Overview
Methyl 5-bromo-2-hydroxy-3-iodobenzoate (CAS 18071-51-7), with molecular formula C8H6BrIO3 and molecular weight 355.85 g/mol. IUPAC: methyl 5-bromo-2-hydroxy-3-iodobenzoate.
Chemical Property Profile of Methyl 5-bromo-2-hydroxy-3-iodobenzoate
Property Insights of Methyl 5-bromo-2-hydroxy-3-iodobenzoate
The XLogP value of 2.5459 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 5-bromo-2-hydroxy-3-iodobenzoate. With a topological polar surface area (TPSA) of 46.53 Ų, Methyl 5-bromo-2-hydroxy-3-iodobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 5-bromo-2-hydroxy-3-iodobenzoate 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 Methyl 5-bromo-2-hydroxy-3-iodobenzoate?
The CAS number of Methyl 5-bromo-2-hydroxy-3-iodobenzoate is 18071-51-7.
What is the molecular formula of Methyl 5-bromo-2-hydroxy-3-iodobenzoate?
The molecular formula of Methyl 5-bromo-2-hydroxy-3-iodobenzoate is C8H6BrIO3.
What is the molecular weight of Methyl 5-bromo-2-hydroxy-3-iodobenzoate?
The molecular weight of Methyl 5-bromo-2-hydroxy-3-iodobenzoate is 355.85 g/mol.
Where can I buy Methyl 5-bromo-2-hydroxy-3-iodobenzoate?
You can request a quote for Methyl 5-bromo-2-hydroxy-3-iodobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 5-bromo-2-hydroxy-3-iodobenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5-bromo-2-hydroxy-3-iodobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.