1-(4-Pyrimidinyl)ethanone
CAS Registry Number®
39870-05-8
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CAS Name
1-(4-Pyrimidinyl)ethanoneMolecular Formula
C6H6N2OMolecular Mass
122.12Cite this Page
1-(4-Pyrimidinyl)ethanone. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=39870-05-8 (retrieved ) (CAS RN: 39870-05-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
70 °C @ Press: 3 TorrMelting Point (2)
67 °C
Source(s)
- (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.
- (2) Robba, Max; Ann. Chim. (Paris), (1960), 380, 414, CAplus
Other Names and Identifiers
InChI
InChI=1S/C6H6N2O/c1-5(9)6-2-3-7-4-8-6/h2-4H,1H3
InChIKey
InChIKey=UZKADDSUUBRMKO-UHFFFAOYSA-N
SMILES
C(C)(=O)C=1C=CN=CN1
Canonical SMILES
O=C(C=1N=CN=CC1)C
Other Names for this Substance
- Ethanone, 1-(4-pyrimidinyl)-
- Ketone, methyl 4-pyrimidinyl
- 1-(4-Pyrimidinyl)ethanone
- Methyl 4-pyrimidinyl ketone
- 4-Pyrimidinyl methyl ketone
