Methyl 2-fluoro-5-(5-methoxypyridin-3-yl)benzoate - CAS 1375068-85-1
Catalog: |
BB059667 |
Product Name: |
Methyl 2-fluoro-5-(5-methoxypyridin-3-yl)benzoate |
CAS: |
1375068-85-1 |
Synonyms: |
Methyl 2-fluoro-5-(5-methoxypyridin-3-yl)benzoate; Methyl2-fluoro-5-(5-methoxypyridin-3-yl)benzoate |
IUPAC Name: | methyl 2-fluoro-5-(5-methoxypyridin-3-yl)benzoate |
Description: | Methyl 2-fluoro-5-(5-methoxypyridin-3-yl)benzoate |
Molecular Weight: | 261.25 |
Molecular Formula: | C14H12FNO3 |
Canonical SMILES: | COC1=CN=CC(=C1)C2=CC(=C(C=C2)F)C(=O)OC |
InChI: | InChI=1S/C14H12FNO3/c1-18-11-5-10(7-16-8-11)9-3-4-13(15)12(6-9)14(17)19-2/h3-8H,1-2H3 |
InChI Key: | DDIZAEXOSLMIMN-UHFFFAOYSA-N |
Complexity: | 313 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 261.08012141 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 261.08012141 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 48.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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