CAS Registry Number: 79324-77-9

Name:

Ethanone, 1-​(3-​iodo-​4-​methoxyphenyl)​-
3-​Iodo-​4-​methoxyacetophenone 

Chemical Formula: C9H9IO2
Exact Mass: 275.96
Molecular Weight: 276.07
m/z: 275.96 (100.0%), 276.97 (9.9%)

InChI: InChI=1S/C9H9IO2/c1-6(11)7-3-4-9(12-2)8(10)5-7/h3-5H,1-2H3
InChIKey: YDTWTLOLPFLZHX-UHFFFAOYSA-N
Canonical SMILES : CC(=O)C1=CC(=C(C=C1)OC)I

Specification

98%

1. (1) Bogert, M. T.; Journal of the American Chemical Society 1923, V45, P2161-7 CAPLUS
2. (2) Pavlinac, Jasminka; Journal of Organic Chemistry 2006, V71(3), P1027-1032 CAPLUS
3. (3) Willgerodt, C.; Justus Liebigs Annalen der Chemie 1912, V389, P292-305 CAPLUS