CAS Registry Number: 1007571-94-9
 Name:

Methyl 2-(4-bromo-3-(3-chloro-5-cyanophenoxy)-2-fluorophenyl)acetate

Chemical Formula: C16H10BrClFNO3
Exact Mass: 396.95
Molecular Weight: 398.61
m/z: 398.95 (100.0%), 396.95 (77.3%), 400.95 (24.7%), 399.95 (17.8%), 397.96 (13.6%), 401.95 (4.2%), 398.96 (1.6%), 400.96 (1.5%)

InChI
InChI=1S/C16H10BrClFNO3/c1-22-14(21)6-10-2-3-13(17)16(15(10)19)23-12-5-9(8-20)4-11(18)7-12/h2-5,7H,6H2,1H3
InChI Key
YAJRUWNONRIBPM-UHFFFAOYSA-N
Canonical SMILES
COC(=O)CC1=C(C(=C(C=C1)Br)OC2=CC(=CC(=C2)C#N)Cl)F

Specification

98%

PCT Int. Appl., 2009080534, 02 Jul 2009

PCT Int. Appl., 2008019968, 21 Feb 2008