4-(4-Carboxy-3-fluorophenyl)-2-methoxyphenol - CAS 1261990-34-4
Catalog: |
BB070589 |
Product Name: |
4-(4-Carboxy-3-fluorophenyl)-2-methoxyphenol |
CAS: |
1261990-34-4 |
Synonyms: |
4-(4-CARBOXY-3-FLUOROPHENYL)-2-METHOXYPHENOL; 2-fluoro-4-(4-hydroxy-3-methoxyphenyl)benzoic acid; 3-Fluoro-4'-hydroxy-3'-methoxy[1,1'-biphenyl]-4-carboxylic acid |
IUPAC Name: | 2-fluoro-4-(4-hydroxy-3-methoxyphenyl)benzoic acid |
Description: | 4-(4-Carboxy-3-fluorophenyl)-2-methoxyphenol |
Molecular Weight: | 262.23 |
Molecular Formula: | C14H11FO4 |
Canonical SMILES: | COC1=C(C=CC(=C1)C2=CC(=C(C=C2)C(=O)O)F)O |
InChI: | InChI=1S/C14H11FO4/c1-19-13-7-9(3-5-12(13)16)8-2-4-10(14(17)18)11(15)6-8/h2-7,16H,1H3,(H,17,18) |
InChI Key: | RPBLACUITICGAB-UHFFFAOYSA-N |
Complexity: | 323 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 262.06413699 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 262.06413699 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 66.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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