Ethyl 2-fluoropyridine-3-carboxylate - CAS 113898-56-9
Catalog: |
BB065717 |
Product Name: |
Ethyl 2-fluoropyridine-3-carboxylate |
CAS: |
113898-56-9 |
Synonyms: |
Ethyl 2-fluoronicotinate; Ethyl 2-fluoropyridine-3-carboxylate; 3-Pyridinecarboxylic acid, 2-fluoro-, ethyl ester; Ethyl2-fluoronicotinate; 2-Fluoro-nicotinic acid ethyl ester |
IUPAC Name: | ethyl 2-fluoropyridine-3-carboxylate |
Description: | Ethyl 2-fluoropyridine-3-carboxylate |
Molecular Weight: | 169.15 |
Molecular Formula: | C8H8FNO2 |
Canonical SMILES: | CCOC(=O)C1=C(N=CC=C1)F |
InChI: | InChI=1S/C8H8FNO2/c1-2-12-8(11)6-4-3-5-10-7(6)9/h3-5H,2H2,1H3 |
InChI Key: | AKVVBYDLMJMJRW-UHFFFAOYSA-N |
Solubility: | Chloroform (Slightly), Methanol (Slightly) |
Appearance: | Colourless Oil |
Storage: | 4°C |
Complexity: | 163 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 169.05390666 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 169.05390666 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 39.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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