Ethyl 2-pentynoate - CAS 55314-57-3
Catalog: |
BB028999 |
Product Name: |
Ethyl 2-pentynoate |
CAS: |
55314-57-3 |
Synonyms: |
ethyl pent-2-ynoate |
IUPAC Name: | ethyl pent-2-ynoate |
Description: | Ethyl 2-pentynoate (CAS# 55314-57-3) is a reactant in the synthesis of pyrazolo[1,5-a]pyridines as PDE4-inhibitors with anti-inflammatory activity. |
Molecular Weight: | 126.15 |
Molecular Formula: | C7H10O2 |
Canonical SMILES: | CCC#CC(=O)OCC |
InChI: | InChI=1S/C7H10O2/c1-3-5-6-7(8)9-4-2/h3-4H2,1-2H3 |
InChI Key: | XDPRPKSTFBPPHU-UHFFFAOYSA-N |
Boiling Point: | 178-179 °C (lit.) |
Density: | 0.957 g/cm3 |
Appearance: | Colorless liquid |
MDL: | MFCD00015221 |
LogP: | 0.96290 |
GHS Hazard Statement: | H226 (100%): Flammable liquid and vapor [Warning Flammable liquids] |
Precautionary Statement: | P210, P233, P240, P241, P242, P243, P261, P280, P285, P303+P361+P353, P304+P341, P305+P351+P338, P310, P342+P311, P370+P378, P403+P235, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-112510259-A | Non-aqueous electrolyte and lithium battery | 20201125 |
CN-111454189-A | Synthetic method of sepiatinib intermediate | 20200512 |
CN-111072543-A | Preparation method and application of (3R,4S) -4-ethylpyrrolidine-3-carboxylic acid compound | 20191113 |
CN-111072543-B | Preparation method and application of (3R,4S) -4-ethylpyrrolidine-3-carboxylic acid compound | 20191113 |
TW-202107759-A | Electrolyte, secondary battery and module | 20190605 |
Complexity: | 147 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 126.068079557 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 126.068079557 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 26.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS