(2E)-3-Ethoxy-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile
TL;DR: (2E)-3-Ethoxy-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile (CAS 869709-82-0) is a chemical compound with molecular formula C9H10N2OS and molecular weight 194.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-ethoxy-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile
Also Known As: (2E)-3-Ethoxy-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile, (2E)-3-ethoxy-2-(4-methyl-1,3-thiazol-2-yl)acrylonitrile, (E)-3-ethoxy-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile
| Molecular Formula | C9H10N2OS |
|---|---|
| Molecular Weight | 194.05 g/mol |
| LogP | 2.3525 |
| Topological Polar Surface Area | 45.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 194.05139 |
| Heavy Atoms | 13 |
| Complexity | 348.74182 |
Chemical Identifiers
| CAS Number | 869709-82-0 |
|---|---|
| SMILES | CCO/C=C(\C#N)/C1=NC(=CS1)C |
Product Overview
(2E)-3-Ethoxy-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile (CAS 869709-82-0), with molecular formula C9H10N2OS and molecular weight 194.05 g/mol. IUPAC: (E)-3-ethoxy-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile.
Chemical Property Profile of (2E)-3-Ethoxy-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile
Property Insights of (2E)-3-Ethoxy-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile
The XLogP value of 2.3525 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-3-Ethoxy-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile. With a topological polar surface area (TPSA) of 45.91 Ų, (2E)-3-Ethoxy-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-3-Ethoxy-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile has 0 hydrogen bond donor(s) and 4 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 (2E)-3-Ethoxy-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile?
The CAS number of (2E)-3-Ethoxy-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile is 869709-82-0.
What is the molecular formula of (2E)-3-Ethoxy-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile?
The molecular formula of (2E)-3-Ethoxy-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile is C9H10N2OS.
What is the molecular weight of (2E)-3-Ethoxy-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile?
The molecular weight of (2E)-3-Ethoxy-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile is 194.05 g/mol.
Where can I buy (2E)-3-Ethoxy-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile?
You can request a quote for (2E)-3-Ethoxy-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-3-Ethoxy-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for (2E)-3-Ethoxy-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.