Ethyl 2-Fluorobenzoate - CAS 443-26-5
Catalog: |
BB025565 |
Product Name: |
Ethyl 2-Fluorobenzoate |
CAS: |
443-26-5 |
Synonyms: |
2-fluorobenzoic acid ethyl ester; ethyl 2-fluorobenzoate |
IUPAC Name: | ethyl 2-fluorobenzoate |
Description: | Ethyl 2-Fluorobenzoate (CAS# 443-26-5) is a useful research chemical. |
Molecular Weight: | 168.17 |
Molecular Formula: | C9H9FO2 |
Canonical SMILES: | CCOC(=O)C1=CC=CC=C1F |
InChI: | InChI=1S/C9H9FO2/c1-2-12-9(11)7-5-3-4-6-8(7)10/h3-6H,2H2,1H3 |
InChI Key: | RUWPGPOBTHOLHF-UHFFFAOYSA-N |
Boiling Point: | 115 °C |
Density: | 1.15 g/cm3 |
MDL: | MFCD00039214 |
LogP: | 2.00240 |
Publication Number | Title | Priority Date |
EP-3875452-A1 | Monoacylglycerol lipase inhibitors | 20200304 |
WO-2021175913-A1 | Monoacylglycerol lipase inhibitors | 20200304 |
EP-3812368-A1 | Method for preparing an n-cyclopropylmethyl aniline compound | 20191025 |
WO-2020257790-A1 | Pharmaceutically active pyrazolo-pyridone modulators of dcn1/2-mediated cullin neddylation | 20190620 |
CN-109678815-A | N- benzyl benzamide derivatives and preparation method thereof and pharmaceutical applications | 20190109 |
Complexity: | 159 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 168.05865769 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 168.05865769 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 26.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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