![3-Methylbenzo[b]thiophene-2-acetic acid structure](/static/products/1505/1505-52-8.webp)
3-Methylbenzo[b]thiophene-2-acetic acid
TL;DR: 3-Methylbenzo[b]thiophene-2-acetic acid (CAS 1505-52-8) is a chemical compound with molecular formula C11H10O2S and molecular weight 206.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-methyl-1-benzothiophen-2-yl)acetic acid
Also Known As: 2-(3-methylbenzo[b]thiophen-2-yl)acetic acid, Maybridge1_005368, 2-(3-methyl-1-benzothiophen-2-yl)acetic acid, Benzo[b]thiophene-2-acetic acid, 3-methyl-, 3-Methylbenzo[b]thiophene-2-acetic acid
| Molecular Formula | C11H10O2S |
|---|---|
| Molecular Weight | 206.04 g/mol |
| LogP | 2.83682 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.04015 |
| Heavy Atoms | 14 |
| Complexity | 484.99323 |
Chemical Identifiers
| CAS Number | 1505-52-8 |
|---|---|
| SMILES | CC1=C(SC2=CC=CC=C12)CC(=O)O |
Product Overview
3-Methylbenzo[b]thiophene-2-acetic acid (CAS 1505-52-8), with molecular formula C11H10O2S and molecular weight 206.04 g/mol. IUPAC: 2-(3-methyl-1-benzothiophen-2-yl)acetic acid.
Chemical Property Profile of 3-Methylbenzo[b]thiophene-2-acetic acid
Property Insights of 3-Methylbenzo[b]thiophene-2-acetic acid
The XLogP value of 2.83682 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methylbenzo[b]thiophene-2-acetic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 3-Methylbenzo[b]thiophene-2-acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methylbenzo[b]thiophene-2-acetic 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 3-Methylbenzo[b]thiophene-2-acetic acid?
The CAS number of 3-Methylbenzo[b]thiophene-2-acetic acid is 1505-52-8.
What is the molecular formula of 3-Methylbenzo[b]thiophene-2-acetic acid?
The molecular formula of 3-Methylbenzo[b]thiophene-2-acetic acid is C11H10O2S.
What is the molecular weight of 3-Methylbenzo[b]thiophene-2-acetic acid?
The molecular weight of 3-Methylbenzo[b]thiophene-2-acetic acid is 206.04 g/mol.
Where can I buy 3-Methylbenzo[b]thiophene-2-acetic acid?
You can request a quote for 3-Methylbenzo[b]thiophene-2-acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methylbenzo[b]thiophene-2-acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Methylbenzo[b]thiophene-2-acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.