4-Methyl-1-phenyl-3-pentanone
CAS Registry Number®
40463-09-0
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CAS Name
4-Methyl-1-phenyl-3-pentanoneMolecular Formula
C12H16OMolecular Mass
176.25Cite this Page
4-Methyl-1-phenyl-3-pentanone. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=40463-09-0 (retrieved ) (CAS RN: 40463-09-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
256 °C @ Press: 760 TorrDensity (1)
0.9755 g/cm³ @ Temp: 40 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C12H16O/c1-10(2)12(13)9-8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3
InChIKey
InChIKey=QATHVLKLWVUSRC-UHFFFAOYSA-N
SMILES
C(CC(C(C)C)=O)C1=CC=CC=C1
Canonical SMILES
O=C(CCC=1C=CC=CC1)C(C)C
Other Names for this Substance
- 3-Pentanone, 4-methyl-1-phenyl-
- 4-Methyl-1-phenyl-3-pentanone
- 2-Methyl-5-phenyl-3-pentanone
- Isopropyl phenethyl ketone
