Ethyl 2-formyl-1-cyclopropanecarboxylate, predominantly trans - CAS 20417-61-2
Catalog: |
BB015908 |
Product Name: |
Ethyl 2-formyl-1-cyclopropanecarboxylate, predominantly trans |
CAS: |
20417-61-2 |
Synonyms: |
ethyl 2-formylcyclopropane-1-carboxylate |
IUPAC Name: | ethyl 2-formylcyclopropane-1-carboxylate |
Description: | 2-Formylcyclopropane-1-carboxylic Acid Ethyl Ester acts as a reagent for the design, synthesis and biological evaluation of first-in-class dual acting histone deacetylase (HDACs) and phosphodiesterase 5 (PDE5) inhibitors for treatment of Alzheimer's disease. |
Molecular Weight: | 142.15 |
Molecular Formula: | C7H10O3 |
Canonical SMILES: | CCOC(=O)C1CC1C=O |
InChI: | InChI=1S/C7H10O3/c1-2-10-7(9)6-3-5(6)4-8/h4-6H,2-3H2,1H3 |
InChI Key: | MDWXTLNIZCHBJE-UHFFFAOYSA-N |
Boiling Point: | 240.7 ℃ at 760 mmHg |
Purity: | 95 % |
Density: | 1.074 g/cm3 |
Appearance: | Colorless to light yellow liquid |
MDL: | MFCD00001285 |
LogP: | 0.38450 |
Publication Number | Title | Priority Date |
WO-2020106558-A1 | Substituted amino triazolopyrimidine and amino triazolopyrazine adenosine receptor antagonists, pharmaceutical compositions and their use | 20181120 |
CN-113015530-A | Substituted aminotriazolopyrimidines and aminotriazolopyrizine adenosine receptor antagonists, pharmaceutical compositions and uses thereof | 20181120 |
EP-3883575-A1 | Substituted amino triazolopyrimidine and amino triazolopyrazine adenosine receptor antagonists, pharmaceutical compositions and their use | 20181120 |
KR-20210093964-A | Substituted amino triazolopyrimidine and amino triazolopyrazine adenosine receptor antagonists, pharmaceutical compositions and uses thereof | 20181120 |
US-2021179587-A1 | Modulators of alpha-1 antitrypsin | 20181005 |
Complexity: | 153 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 142.062994177 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 142.062994177 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 43.4 |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.1 |
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