5-(2-Fluorophenyl)nicotinic Acid - CAS 705961-96-2
Catalog: |
BB034190 |
Product Name: |
5-(2-Fluorophenyl)nicotinic Acid |
CAS: |
705961-96-2 |
Synonyms: |
5-(2-fluorophenyl)-3-pyridinecarboxylic acid; 5-(2-fluorophenyl)pyridine-3-carboxylic acid |
IUPAC Name: | 5-(2-fluorophenyl)pyridine-3-carboxylic acid |
Description: | 5-(2-Fluorophenyl)nicotinic Acid (CAS# 705961-96-2 ) is a useful research chemical. |
Molecular Weight: | 217.20 |
Molecular Formula: | C12H8FNO2 |
Canonical SMILES: | C1=CC=C(C(=C1)C2=CC(=CN=C2)C(=O)O)F |
InChI: | InChI=1S/C12H8FNO2/c13-11-4-2-1-3-10(11)8-5-9(12(15)16)7-14-6-8/h1-7H,(H,15,16) |
InChI Key: | UEEMCRBSNWWVAA-UHFFFAOYSA-N |
LogP: | 2.58590 |
Publication Number | Title | Priority Date |
JP-2015174857-A | Collagen production promoter | 20140318 |
JP-6324777-B2 | Collagen production promoter | 20140318 |
AU-2011237936-A1 | Pyrazol-4-yl-heterocyclyl-carboxamide compounds and methods of use | 20100407 |
CA-2794801-A1 | Pyrazol-4-yl-heterocyclyl-carboxamide compounds and methods of use | 20100407 |
CA-2794801-C | Pyrazol-4-yl-heterocyclyl-carboxamide compounds and methods of use | 20100407 |
Complexity: | 259 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 217.05390666 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 217.05390666 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 50.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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