CAS Registry Number: 394-50-3

Name:

Benzaldehyde, 3-​fluoro-​2-​hydroxy-
Salicylaldehyde, 3-​fluoro- (8CI); 2-​Hydroxy-​3-​fluorobenzaldehyde; 3-​Fluoro-​2-​hydroxybenzaldehyde; 3-​Fluorosalicylaldehyd​e 

Deleted CAS Registry Numbers: 1186390-​98-​6

Chemical Formula: C7H5FO2
Exact Mass: 140.03
Molecular Weight: 140.11
m/z: 140.03 (100.0%), 141.03 (7.7%)
Elemental Analysis: C, 60.01; H, 3.60; F, 13.56; O, 22.84

InChI: InChI=1S/C7H5FO2/c8-6-3-1-2-5(4-9)7(6)10/h1-4,10H
InChIKey: NWDHTEIVMDYWQJ-UHFFFAOYSA-N
Canonical SMILES : C1=CC(=C(C(=C1)F)O)C=O

Specification

98%

1. (1) Hansen, Poul Erik; Acta Chemica Scandinavica 1997, V51(8), P881-888 CAPLUS
2. (2) Kauch, Matthias; Synthesis 2006, (10), P1575-1577 CAPLUS
3. (3) BIORAD: Infrared spectral data from the Bio-Rad/Sadtler IR Data Collection was obtained from Bio-Rad Laboratories, Philadelphia, PA (US). Copyright © Bio-Rad Laboratories. All Rights Reserved.
4. (4) WSS: Spectral data were obtained from Wiley Subscription Services, Inc. (US)
5. (5) Aymes, Daniel J.; Bulletin de la Societe Chimique de France 1980, (3-4, Pt. 2), P175-8 CAPLUS
6. (6) Ferguson, Lloyd N.; Journal of the American Chemical Society 1946, V68, P2502-4 CAPLUS
7. (7) Dobler, Markus; GB 2357971 A 2001 CAPLUS
8. (8) Kiralj, Rudolf; Journal of Physical Chemistry A 2008, V112(27), P6134-6149 CAPLUS