5-Bromo-benzo(b)thiophene-2-carboxylic acid methyl ester
TL;DR: 5-Bromo-benzo(b)thiophene-2-carboxylic acid methyl ester (CAS 7312-11-0) is a chemical compound with molecular formula C10H7BrO2S and molecular weight 269.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-bromo-1-benzothiophene-2-carboxylate
Also Known As: methyl 5-bromo-1-benzothiophene-2-carboxylate, methyl 5-bromobenzo[b]thiophene-2-carboxylate, Maybridge4_002488, 5-Bromo-benzo[b]thiophene-2-carboxylic acid methyl ester, 5-bromobenzothiophene-2-carboxylic acid methyl ester
| Molecular Formula | C10H7BrO2S |
|---|---|
| Molecular Weight | 269.94 g/mol |
| LogP | 3.4504 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 269.935 |
| Heavy Atoms | 14 |
| Complexity | 489.8277 |
Chemical Identifiers
| CAS Number | 7312-11-0 |
|---|---|
| SMILES | COC(=O)C1=CC2=C(S1)C=CC(=C2)Br |
Product Overview
5-Bromo-benzo(b)thiophene-2-carboxylic acid methyl ester (CAS 7312-11-0), with molecular formula C10H7BrO2S and molecular weight 269.94 g/mol. IUPAC: methyl 5-bromo-1-benzothiophene-2-carboxylate.
Chemical Property Profile of 5-Bromo-benzo(b)thiophene-2-carboxylic acid methyl ester
Property Insights of 5-Bromo-benzo(b)thiophene-2-carboxylic acid methyl ester
The XLogP value of 3.4504 indicates that 5-Bromo-benzo(b)thiophene-2-carboxylic acid methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 5-Bromo-benzo(b)thiophene-2-carboxylic acid methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromo-benzo(b)thiophene-2-carboxylic acid methyl ester has 0 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 5-Bromo-benzo(b)thiophene-2-carboxylic acid methyl ester?
The CAS number of 5-Bromo-benzo(b)thiophene-2-carboxylic acid methyl ester is 7312-11-0.
What is the molecular formula of 5-Bromo-benzo(b)thiophene-2-carboxylic acid methyl ester?
The molecular formula of 5-Bromo-benzo(b)thiophene-2-carboxylic acid methyl ester is C10H7BrO2S.
What is the molecular weight of 5-Bromo-benzo(b)thiophene-2-carboxylic acid methyl ester?
The molecular weight of 5-Bromo-benzo(b)thiophene-2-carboxylic acid methyl ester is 269.94 g/mol.
Where can I buy 5-Bromo-benzo(b)thiophene-2-carboxylic acid methyl ester?
You can request a quote for 5-Bromo-benzo(b)thiophene-2-carboxylic acid methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Bromo-benzo(b)thiophene-2-carboxylic acid methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-benzo(b)thiophene-2-carboxylic acid methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.