6-(2-Fluoro-5-methoxycarbonylphenyl)-2-formylphenol - CAS 1261919-29-2
Catalog: |
BB064910 |
Product Name: |
6-(2-Fluoro-5-methoxycarbonylphenyl)-2-formylphenol |
CAS: |
1261919-29-2 |
Synonyms: |
6-(2-FLUORO-5-METHOXYCARBONYLPHENYL)-2-FORMYLPHENOL; Methyl 6-fluoro-3'-formyl-2'-hydroxy-[1,1'-biphenyl]-3-carboxylate; methyl 4-fluoro-3-(3-formyl-2-hydroxyphenyl)benzoate; Methyl6-fluoro-3'-formyl-2'-hydroxy-[1,1'-biphenyl]-3-carboxylate |
IUPAC Name: | methyl 4-fluoro-3-(3-formyl-2-hydroxyphenyl)benzoate |
Description: | 6-(2-Fluoro-5-methoxycarbonylphenyl)-2-formylphenol |
Molecular Weight: | 274.24 |
Molecular Formula: | C15H11FO4 |
Canonical SMILES: | COC(=O)C1=CC(=C(C=C1)F)C2=CC=CC(=C2O)C=O |
InChI: | InChI=1S/C15H11FO4/c1-20-15(19)9-5-6-13(16)12(7-9)11-4-2-3-10(8-17)14(11)18/h2-8,18H,1H3 |
InChI Key: | NEKWWIBUUQWZHM-UHFFFAOYSA-N |
Complexity: | 360 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 274.06413699 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 274.06413699 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 63.6Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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