(E)-2-acetamido-3-thiophen-2-ylprop-2-enoic acid
TL;DR: (E)-2-acetamido-3-thiophen-2-ylprop-2-enoic acid (CAS 69181-26-6) is a chemical compound with molecular formula C9H9NO3S and molecular weight 211.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-acetamido-3-thiophen-2-ylprop-2-enoic acid
Also Known As: ChemDiv3_004031, 2- -3- -2-propenoicacid, 2-acetamido-3-(2-thienyl)acrylic acid, 2-(acetylamino)-3-(2-thienyl)-2-propenoic acid, (E)-2-acetamido-3-thiophen-2-ylprop-2-enoic acid
| Molecular Formula | C9H9NO3S |
|---|---|
| Molecular Weight | 211.03 g/mol |
| LogP | 1.3097 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 211.03032 |
| Heavy Atoms | 14 |
| Complexity | 367.4186 |
Chemical Identifiers
| CAS Number | 69181-26-6 |
|---|---|
| SMILES | CC(=O)N/C(=C/C1=CC=CS1)/C(=O)O |
Product Overview
(E)-2-acetamido-3-thiophen-2-ylprop-2-enoic acid (CAS 69181-26-6), with molecular formula C9H9NO3S and molecular weight 211.03 g/mol. IUPAC: (E)-2-acetamido-3-thiophen-2-ylprop-2-enoic acid.
Chemical Property Profile of (E)-2-acetamido-3-thiophen-2-ylprop-2-enoic acid
Property Insights of (E)-2-acetamido-3-thiophen-2-ylprop-2-enoic acid
The XLogP value of 1.3097 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-2-acetamido-3-thiophen-2-ylprop-2-enoic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-acetamido-3-thiophen-2-ylprop-2-enoic acid. Following Lipinski's Rule of Five, (E)-2-acetamido-3-thiophen-2-ylprop-2-enoic acid has 2 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 (E)-2-acetamido-3-thiophen-2-ylprop-2-enoic acid?
The CAS number of (E)-2-acetamido-3-thiophen-2-ylprop-2-enoic acid is 69181-26-6.
What is the molecular formula of (E)-2-acetamido-3-thiophen-2-ylprop-2-enoic acid?
The molecular formula of (E)-2-acetamido-3-thiophen-2-ylprop-2-enoic acid is C9H9NO3S.
What is the molecular weight of (E)-2-acetamido-3-thiophen-2-ylprop-2-enoic acid?
The molecular weight of (E)-2-acetamido-3-thiophen-2-ylprop-2-enoic acid is 211.03 g/mol.
Where can I buy (E)-2-acetamido-3-thiophen-2-ylprop-2-enoic acid?
You can request a quote for (E)-2-acetamido-3-thiophen-2-ylprop-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-acetamido-3-thiophen-2-ylprop-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-acetamido-3-thiophen-2-ylprop-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.