Ethyl 4-Fluorophenylacetate - CAS 587-88-2
Catalog: |
BB030163 |
Product Name: |
Ethyl 4-Fluorophenylacetate |
CAS: |
587-88-2 |
Synonyms: |
2-(4-fluorophenyl)acetic acid ethyl ester; ethyl 2-(4-fluorophenyl)acetate |
IUPAC Name: | ethyl 2-(4-fluorophenyl)acetate |
Description: | Ethyl 4-Fluorophenylacetate (CAS# 587-88-2) is a useful research chemical. |
Molecular Weight: | 182.19 |
Molecular Formula: | C10H11FO2 |
Canonical SMILES: | CCOC(=O)CC1=CC=C(C=C1)F |
InChI: | InChI=1S/C10H11FO2/c1-2-13-10(12)7-8-3-5-9(11)6-4-8/h3-6H,2,7H2,1H3 |
InChI Key: | VMWJHHAOVXQCLE-UHFFFAOYSA-N |
Boiling Point: | 230.5 °C at 760 mmHg |
Density: | 1.118 g/cm3 |
MDL: | MFCD08235152 |
LogP: | 1.93130 |
Publication Number | Title | Priority Date |
WO-2021188936-A1 | Phd inhibitor compounds, compositions, and use | 20200320 |
CN-110803992-A | Preparation method of 3-nitro-4-fluoroacetophenone acetate | 20191127 |
JP-2021521104-A | Substituted benzofurans, benzopyrroles, benzothiophenes, and structurally related complement inhibitors | 20180406 |
EP-3541812-A1 | Mglur7 agonist compounds for treating mglur7- regulated diseases, disorders, or conditions | 20161118 |
JP-2020502063-A | mGluR7 agonist compounds for treating mGluR7-modulating diseases, disorders or conditions | 20161118 |
PMID | Publication Date | Title | Journal |
21201524 | 20080123 | 4-(4-Fluoro-phen-yl)-2-methyl-3-(1-oxy-4-pyridyl)isoxazol-5(2H)-one | Acta crystallographica. Section E, Structure reports online |
21200862 | 20071218 | 4-[4-(4-Fluoro-phen-yl)-2-methyl-5-oxo-2,5-dihydro-isoxazol-3-yl]-1-methyl-pyridinium iodide-4-[3-(4-fluoro-phen-yl)-2-methyl-5-oxo-2,5-dihydro-isoxazol-4-yl]-1-methyl-pyridinium iodide (0.6/0.4) | Acta crystallographica. Section E, Structure reports online |
Complexity: | 162 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 182.07430775 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 182.07430775 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 26.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS