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CAS Number: 98027-52-2
1-(4-iodo-1H-pyrazol-1-yl)ethanone

Structure

1-(4-iodo-1H-pyrazol-1-yl)ethanone
Name: 1-(4-iodo-1H-pyrazol-1-yl)ethanone
Synonyms:
General Information
Product Number: 98027522

CAS Registry Number 98027-52-2
Name:
Ethanone, 1-​(4-​iodo-​1H-​pyrazol-​1-​yl)​-
1H-Pyrazole, 1-acetyl-4-iodo- (9CI)
Pyrazole, 1-acetyl-4-iodo- (6CI)
1-Acetyl-4-iodo-1H-pyrazole

 

Chemical Formula: C5H5IN2O
Exact Mass: 235.94
Molecular Weight: 236.01
m/z: 235.94 (100.0%), 236.95 (5.5%)

 

InChI:InChI=1S/C5H5IN2O/c1-4(9)8-3-5(6)2-7-8/h2-3H,1H3

InChI Key:VQBDZJOQOOMNRZ-UHFFFAOYSA-N

Canonical SMILES:CC(=O)N1C=C(C=N1)I

Specification

98%

References
  1. (1) Holzer, Wolfgang; Journal of Heterocyclic Chemistry 1995, V32(1), P189-94 CAPLUS
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