2-(1,1-Dioxo-2,3-dihydro-1lambda6-thiophen-3-yl)acetic acid
TL;DR: 2-(1,1-Dioxo-2,3-dihydro-1lambda6-thiophen-3-yl)acetic acid (CAS 17236-25-8) is a chemical compound with molecular formula C6H8O4S and molecular weight 176.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,1-dioxo-2,3-dihydrothiophen-3-yl)acetic acid
Also Known As: 2-(1,1-dioxido-2,3-dihydrothiophen-3-yl)acetic acid, (1,1-dioxido-2,3-dihydro-3-thienyl)acetic acid, 2-(1,1-dioxo-2,3-dihydrothiophen-3-yl)acetic acid, 3-Thiopheneacetic acid,2,3-dihydro-, 1,1-dioxide, IDI1_008162
| Molecular Formula | C6H8O4S |
|---|---|
| Molecular Weight | 176.01 g/mol |
| LogP | 0.0194 |
| Topological Polar Surface Area | 71.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 176.01433 |
| Heavy Atoms | 11 |
| Complexity | 287.70413 |
Chemical Identifiers
| CAS Number | 17236-25-8 |
|---|---|
| SMILES | C1C(C=CS1(=O)=O)CC(=O)O |
Product Overview
2-(1,1-Dioxo-2,3-dihydro-1lambda6-thiophen-3-yl)acetic acid (CAS 17236-25-8), with molecular formula C6H8O4S and molecular weight 176.01 g/mol. IUPAC: 2-(1,1-dioxo-2,3-dihydrothiophen-3-yl)acetic acid.
Chemical Property Profile of 2-(1,1-Dioxo-2,3-dihydro-1lambda6-thiophen-3-yl)acetic acid
Property Insights of 2-(1,1-Dioxo-2,3-dihydro-1lambda6-thiophen-3-yl)acetic acid
The XLogP value of 0.0194 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1,1-Dioxo-2,3-dihydro-1lambda6-thiophen-3-yl)acetic acid. The TPSA of 71.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1,1-Dioxo-2,3-dihydro-1lambda6-thiophen-3-yl)acetic acid. Following Lipinski's Rule of Five, 2-(1,1-Dioxo-2,3-dihydro-1lambda6-thiophen-3-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-(1,1-Dioxo-2,3-dihydro-1lambda6-thiophen-3-yl)acetic acid?
The CAS number of 2-(1,1-Dioxo-2,3-dihydro-1lambda6-thiophen-3-yl)acetic acid is 17236-25-8.
What is the molecular formula of 2-(1,1-Dioxo-2,3-dihydro-1lambda6-thiophen-3-yl)acetic acid?
The molecular formula of 2-(1,1-Dioxo-2,3-dihydro-1lambda6-thiophen-3-yl)acetic acid is C6H8O4S.
What is the molecular weight of 2-(1,1-Dioxo-2,3-dihydro-1lambda6-thiophen-3-yl)acetic acid?
The molecular weight of 2-(1,1-Dioxo-2,3-dihydro-1lambda6-thiophen-3-yl)acetic acid is 176.01 g/mol.
Where can I buy 2-(1,1-Dioxo-2,3-dihydro-1lambda6-thiophen-3-yl)acetic acid?
You can request a quote for 2-(1,1-Dioxo-2,3-dihydro-1lambda6-thiophen-3-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-(1,1-Dioxo-2,3-dihydro-1lambda6-thiophen-3-yl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,1-Dioxo-2,3-dihydro-1lambda6-thiophen-3-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.