CAS Registry Number: 72235-55-3

Name:

Benzenemethanamine, 3-​chloro-​2-​fluoro-
3-​Chloro-​2-​fluorobenzylamine 

Chemical Formula: C7H7ClFN
Exact Mass: 159.03
Molecular Weight: 159.59
m/z: 159.03 (100.0%), 161.02 (32.0%), 160.03 (7.7%), 162.03 (2.4%)
Elemental Analysis: C, 52.68; H, 4.42; Cl, 22.22; F, 11.90; N, 8.78

InChI: InChI=1S/C7H7ClFN/c8-6-3-1-2-5(4-10)7(6)9/h1-3H,4,10H2
InChIKey: LYKWZKBLNOCJMA-UHFFFAOYSA-N
Canonical SMILES : C1=CC(=C(C(=C1)Cl)F)CN

Specification

98%

PCT Int. Appl. (2014), WO 2014104279 A1 20140703.

PCT Int. Appl. (2014), WO 2014100323 A1 20140626.