Pinacolone
CAS Registry Number®
75-97-8
CAS Name
PinacoloneMolecular Formula
C6H12OMolecular Mass
100.16Cite this Page
Pinacolone. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=75-97-8 (retrieved ) (CAS RN: 75-97-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
106.1 °CMelting Point (2)
-52.5 °CDensity (1)
0.7229 g/cm³ @ Temp: 25 °C
Source(s)
- (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)
- (2) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
Other Names and Identifiers
InChI
InChI=1S/C6H12O/c1-5(7)6(2,3)4/h1-4H3
InChIKey
InChIKey=PJGSXYOJTGTZAV-UHFFFAOYSA-N
SMILES
C(C(C)=O)(C)(C)C
Canonical SMILES
O=C(C)C(C)(C)C
Other Names for this Substance
- 2-Butanone, 3,3-dimethyl-
- 3,3-Dimethyl-2-butanone
- tert-Butyl methyl ketone
- Methyl tert-butyl ketone
- Pinacolin