CAS Registry Number: 364064-17-5

Name:

3-​Pyridinecarboxylic acid, 5-​(4-​fluorophenyl)​-
EMD 50929 

Chemical Formula: C12H8FNO2
Exact Mass: 217.05
Molecular Weight: 217.20
m/z: 217.05 (100.0%), 218.06 (13.1%), 219.06 (1.2%)

InChI: InChI=1S/C12H8FNO2/c13-11-3-1-8(2-4-11)9-5-10(12(15)16)7-14-6-9/h1-7H,(H,15,16)
InChIKey: KISDAKHYANOMTN-UHFFFAOYSA-N
Canonical SMILES : C1=CC(=CC=C1C2=CC(=CN=C2)C(=O)O)F

Specification

98%

1. (1) Fernandez, Joan-Carles; Tetrahedron Letters 2005, V46(4), P581-585 CAPLUS