Ethyl 3-(3-Pyridyl)propiolate - CAS 59608-03-6
Catalog: |
BB030431 |
Product Name: |
Ethyl 3-(3-Pyridyl)propiolate |
CAS: |
59608-03-6 |
Synonyms: |
3-(3-pyridinyl)-2-propynoic acid ethyl ester; ethyl 3-pyridin-3-ylprop-2-ynoate |
IUPAC Name: | ethyl 3-pyridin-3-ylprop-2-ynoate |
Description: | Ethyl 3-(3-Pyridyl)propiolate (CAS# 59608-03-6) is a useful research chemical. |
Molecular Weight: | 175.18 |
Molecular Formula: | C10H9NO2 |
Canonical SMILES: | CCOC(=O)C#CC1=CN=CC=C1 |
InChI: | InChI=1S/C10H9NO2/c1-2-13-10(12)6-5-9-4-3-7-11-8-9/h3-4,7-8H,2H2,1H3 |
InChI Key: | CCSGBVGBVULUAC-UHFFFAOYSA-N |
LogP: | 0.99620 |
Publication Number | Title | Priority Date |
AU-2011329486-A1 | Compounds | 20101118 |
TW-201221518-A | Compounds | 20101118 |
WO-2012067664-A1 | Compounds | 20101118 |
EP-0304057-A2 | Pyridinone derivatives, and agricultural and horticultural fungicidal compositions containing the same | 19870818 |
EP-0304057-B1 | Pyridinone derivatives, and agricultural and horticultural fungicidal compositions containing the same | 19870818 |
Complexity: | 236 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 175.06332853 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 175.06332853 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 39.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS