2-(5-Benzoylthiophen-2-yl)acetic acid
TL;DR: 2-(5-Benzoylthiophen-2-yl)acetic acid (CAS 33006-00-7) is a chemical compound with molecular formula C13H10O3S and molecular weight 246.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-benzoylthiophen-2-yl)acetic acid
Also Known As: 2-(5-benzoylthiophen-2-yl)acetic acid, 2-(5-benzoyl-2-thienyl)acetic acid, (5-benzoyl-2-thienyl)acetic acid, 5-benzoyl-thiophene-2-acetic acid, (5-benzoylthiophen-2-yl)acetic acid
| Molecular Formula | C13H10O3S |
|---|---|
| Molecular Weight | 246.04 g/mol |
| LogP | 2.6062 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 246.03506 |
| Heavy Atoms | 17 |
| Complexity | 542.80206 |
Chemical Identifiers
| CAS Number | 33006-00-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C2=CC=C(S2)CC(=O)O |
Product Overview
2-(5-Benzoylthiophen-2-yl)acetic acid (CAS 33006-00-7), with molecular formula C13H10O3S and molecular weight 246.04 g/mol. IUPAC: 2-(5-benzoylthiophen-2-yl)acetic acid.
Chemical Property Profile of 2-(5-Benzoylthiophen-2-yl)acetic acid
Property Insights of 2-(5-Benzoylthiophen-2-yl)acetic acid
The XLogP value of 2.6062 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(5-Benzoylthiophen-2-yl)acetic acid. With a topological polar surface area (TPSA) of 54.37 Ų, 2-(5-Benzoylthiophen-2-yl)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(5-Benzoylthiophen-2-yl)acetic acid 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 2-(5-Benzoylthiophen-2-yl)acetic acid?
The CAS number of 2-(5-Benzoylthiophen-2-yl)acetic acid is 33006-00-7.
What is the molecular formula of 2-(5-Benzoylthiophen-2-yl)acetic acid?
The molecular formula of 2-(5-Benzoylthiophen-2-yl)acetic acid is C13H10O3S.
What is the molecular weight of 2-(5-Benzoylthiophen-2-yl)acetic acid?
The molecular weight of 2-(5-Benzoylthiophen-2-yl)acetic acid is 246.04 g/mol.
Where can I buy 2-(5-Benzoylthiophen-2-yl)acetic acid?
You can request a quote for 2-(5-Benzoylthiophen-2-yl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(5-Benzoylthiophen-2-yl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(5-Benzoylthiophen-2-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.