5-Bromo-3-methyl-1-benzofuran-2-carboxylic acid
TL;DR: 5-Bromo-3-methyl-1-benzofuran-2-carboxylic acid (CAS 50638-08-9) is a chemical compound with molecular formula C10H7BrO3 and molecular weight 253.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-3-methyl-1-benzofuran-2-carboxylic acid
Also Known As: 5-bromo-3-methyl-benzofuran-2-carboxylic Acid, 5-Bromo-3-methylbenzofuran-2-carboxylic acid, 5-bromo-3-methyl-1-benzofuran-2-carboxylic acid, ISOPROPYL(S)-(-)-LACTATE, methyl 5-bromobenzofuran-2-carboxylic acid
| Molecular Formula | C10H7BrO3 |
|---|---|
| Molecular Weight | 253.96 g/mol |
| LogP | 3.20192 |
| Topological Polar Surface Area | 50.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 253.95786 |
| Heavy Atoms | 14 |
| Complexity | 513.30664 |
Chemical Identifiers
| CAS Number | 50638-08-9 |
|---|---|
| SMILES | CC1=C(OC2=C1C=C(C=C2)Br)C(=O)O |
Product Overview
5-Bromo-3-methyl-1-benzofuran-2-carboxylic acid (CAS 50638-08-9), with molecular formula C10H7BrO3 and molecular weight 253.96 g/mol. IUPAC: 5-bromo-3-methyl-1-benzofuran-2-carboxylic acid.
Chemical Property Profile of 5-Bromo-3-methyl-1-benzofuran-2-carboxylic acid
Property Insights of 5-Bromo-3-methyl-1-benzofuran-2-carboxylic acid
The XLogP value of 3.20192 indicates that 5-Bromo-3-methyl-1-benzofuran-2-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.44 Ų, 5-Bromo-3-methyl-1-benzofuran-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromo-3-methyl-1-benzofuran-2-carboxylic 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 5-Bromo-3-methyl-1-benzofuran-2-carboxylic acid?
The CAS number of 5-Bromo-3-methyl-1-benzofuran-2-carboxylic acid is 50638-08-9.
What is the molecular formula of 5-Bromo-3-methyl-1-benzofuran-2-carboxylic acid?
The molecular formula of 5-Bromo-3-methyl-1-benzofuran-2-carboxylic acid is C10H7BrO3.
What is the molecular weight of 5-Bromo-3-methyl-1-benzofuran-2-carboxylic acid?
The molecular weight of 5-Bromo-3-methyl-1-benzofuran-2-carboxylic acid is 253.96 g/mol.
Where can I buy 5-Bromo-3-methyl-1-benzofuran-2-carboxylic acid?
You can request a quote for 5-Bromo-3-methyl-1-benzofuran-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Bromo-3-methyl-1-benzofuran-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-3-methyl-1-benzofuran-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.