CAS Registry Number: 106614-28-2

Name:

Benzoic acid, 2,​4-​difluoro-​, methyl ester
2,​4-​Difluorobenzoic acid methyl ester; Methyl 2,​4-​difluorobenzoate 

Chemical Formula: C8H6F2O2
Exact Mass: 172.03
Molecular Weight: 172.13
m/z: 172.03 (100.0%), 173.04 (8.8%)
Elemental Analysis: C, 55.82; H, 3.51; F, 22.07; O, 18.59

InChI: InChI=1S/C8H6F2O2/c1-12-8(11)6-3-2-5(9)4-7(6)10/h2-4H,1H3
InChIKey: YQUHULOBTDYMAG-UHFFFAOYSA-N
Canonical SMILES : COC(=O)C1=C(C=C(C=C1)F)F

Specification

98%

1. (1) Ebert, Greg W.; Journal of Organic Chemistry 2005, V70(11), P4314-4317 CAPLUS