Methyl 2-Fluoro-6-(pyrrolidin-1-yl)nicotinate - CAS 1228666-19-0
Catalog: |
BB059687 |
Product Name: |
Methyl 2-Fluoro-6-(pyrrolidin-1-yl)nicotinate |
CAS: |
1228666-19-0 |
Synonyms: |
2-Fluoro-6-(1-pyrrolidinyl)-3-pyridinecarboxylic Acid Methyl Ester |
IUPAC Name: | methyl 2-fluoro-6-pyrrolidin-1-ylpyridine-3-carboxylate |
Description: | Methyl 2-Fluoro-6-(pyrrolidin-1-yl)nicotinate (cas# 1228666-19-0) is a compound useful in organic synthesis. |
Molecular Weight: | 224.23 |
Molecular Formula: | C11H13FN2O2 |
Canonical SMILES: | COC(=O)C1=C(N=C(C=C1)N2CCCC2)F |
InChI: | InChI=1S/C11H13FN2O2/c1-16-11(15)8-4-5-9(13-10(8)12)14-6-2-3-7-14/h4-5H,2-3,6-7H2,1H3 |
InChI Key: | VRYUNSCOULEJPJ-UHFFFAOYSA-N |
Complexity: | 256 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 224.09610582 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 224.09610582 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 42.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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