4-(5-Carboxy-2-fluorophenyl)phenol - CAS 1181608-84-3
Catalog: |
BB070572 |
Product Name: |
4-(5-Carboxy-2-fluorophenyl)phenol |
CAS: |
1181608-84-3 |
Synonyms: |
4-(5-CARBOXY-2-FLUOROPHENYL)PHENOL; 4-fluoro-3-(4-hydroxyphenyl)benzoic acid; 6-Fluoro-4'-hydroxy[1,1'-biphenyl]-3-carboxylic acid |
IUPAC Name: | 4-fluoro-3-(4-hydroxyphenyl)benzoic acid |
Description: | 4-(5-Carboxy-2-fluorophenyl)phenol |
Molecular Weight: | 232.21 |
Molecular Formula: | C13H9FO3 |
Canonical SMILES: | C1=CC(=CC=C1C2=C(C=CC(=C2)C(=O)O)F)O |
InChI: | InChI=1S/C13H9FO3/c14-12-6-3-9(13(16)17)7-11(12)8-1-4-10(15)5-2-8/h1-7,15H,(H,16,17) |
InChI Key: | RIKYUNRNITULQO-UHFFFAOYSA-N |
Complexity: | 274 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 232.05357231 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 232.05357231 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 57.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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