2-Propenoic acid, 2-cyano-3-(3-pyridinyl)-, ethyl ester
TL;DR: 2-Propenoic acid, 2-cyano-3-(3-pyridinyl)-, ethyl ester (CAS 136633-60-8) is a chemical compound with molecular formula C11H10N2O2 and molecular weight 202.07423 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-cyano-3-pyridin-3-ylprop-2-enoate
Also Known As: Ethyl 2-Cyano-3-(3-pyridyl)acrylate, ethyl 2-cyano-3-(3-pyridinyl)acrylate, Ethyl 2-cyano-3-(pyridin-3-yl)acrylate, ethyl 2-cyano-3-pyridin-3-ylprop-2-enoate, Ethyl2-Cyano-3-(3-pyridyl)acrylate
Technical Specifications
| Molecular Formula | C11H10N2O2 |
| Molecular Weight | 202.07423 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 63.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 202.07423 Da |
| Heavy Atoms | 15 |
| Complexity | 301.0 |
| SMILES | CCOC(=O)C(=CC1=CN=CC=C1)C#N |
| InChIKey | BMMBXBIFKMYOLF-UHFFFAOYSA-N |
Chemical Property Profile of 2-Propenoic acid, 2-cyano-3-(3-pyridinyl)-, ethyl ester
Property Insights of 2-Propenoic acid, 2-cyano-3-(3-pyridinyl)-, ethyl ester
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propenoic acid, 2-cyano-3-(3-pyridinyl)-, ethyl ester. The TPSA of 63.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propenoic acid, 2-cyano-3-(3-pyridinyl)-, ethyl ester. Following Lipinski's Rule of Five, 2-Propenoic acid, 2-cyano-3-(3-pyridinyl)-, ethyl ester 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
What is the CAS number of 2-Propenoic acid, 2-cyano-3-(3-pyridinyl)-, ethyl ester?
The CAS number of 2-Propenoic acid, 2-cyano-3-(3-pyridinyl)-, ethyl ester is 136633-60-8.
What is the molecular formula of 2-Propenoic acid, 2-cyano-3-(3-pyridinyl)-, ethyl ester?
The molecular formula of 2-Propenoic acid, 2-cyano-3-(3-pyridinyl)-, ethyl ester is C11H10N2O2.
What is the molecular weight of 2-Propenoic acid, 2-cyano-3-(3-pyridinyl)-, ethyl ester?
The molecular weight of 2-Propenoic acid, 2-cyano-3-(3-pyridinyl)-, ethyl ester is 202.07423 g/mol.
Where can I buy 2-Propenoic acid, 2-cyano-3-(3-pyridinyl)-, ethyl ester?
You can request a quote for 2-Propenoic acid, 2-cyano-3-(3-pyridinyl)-, ethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Propenoic acid, 2-cyano-3-(3-pyridinyl)-, ethyl ester?
Yes, CoreyChem provides custom synthesis services for 2-Propenoic acid, 2-cyano-3-(3-pyridinyl)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.