Methyl 2-fluoro-4-(3-fluoro-5-methoxyphenyl)benzoate - CAS 1365272-01-0
Catalog: |
BB059660 |
Product Name: |
Methyl 2-fluoro-4-(3-fluoro-5-methoxyphenyl)benzoate |
CAS: |
1365272-01-0 |
Synonyms: |
Methyl 2-fluoro-4-(3-fluoro-5-methoxyphenyl)benzoate; Methyl 3,3'-difluoro-5'-methoxy-[1,1'-biphenyl]-4-carboxylate; Methyl3,3'-difluoro-5'-methoxy-[1,1'-biphenyl]-4-carboxylate; Methyl 3,3'-difluoro-5'-methoxy[1,1'-biphenyl]-4-carboxylate |
IUPAC Name: | methyl 2-fluoro-4-(3-fluoro-5-methoxyphenyl)benzoate |
Description: | Methyl 2-fluoro-4-(3-fluoro-5-methoxyphenyl)benzoate |
Molecular Weight: | 278.25 |
Molecular Formula: | C15H12F2O3 |
Canonical SMILES: | COC1=CC(=CC(=C1)C2=CC(=C(C=C2)C(=O)OC)F)F |
InChI: | InChI=1S/C15H12F2O3/c1-19-12-6-10(5-11(16)8-12)9-3-4-13(14(17)7-9)15(18)20-2/h3-8H,1-2H3 |
InChI Key: | RJWCLQYHKMSLIJ-UHFFFAOYSA-N |
Complexity: | 337 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 278.07545056 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 278.07545056 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 35.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.6 |
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