Isomethyl-α-ionone
CAS Registry Number®
127-51-5
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CAS Name
Isomethyl-α-iononeMolecular Formula
C14H22OMolecular Mass
206.32Cite this Page
Isomethyl-α-ionone. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=127-51-5 (retrieved ) (CAS RN: 127-51-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
121-122 °C @ Press: 9 TorrDensity (2)
0.9345 g/cm³ @ Temp: 20 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C14H22O/c1-10-7-6-8-14(4,5)13(10)9-11(2)12(3)15/h7,9,13H,6,8H2,1-5H3
InChIKey
InChIKey=JRJBVWJSTHECJK-UHFFFAOYSA-N
SMILES
C(=C(C(C)=O)C)C1C(C)(C)CCC=C1C
Canonical SMILES
O=C(C(=CC1C(=CCCC1(C)C)C)C)C
Other Names for this Substance
- 3-Buten-2-one, 3-methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-
- 3-Methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-buten-2-one
- α-Cetone
- 4-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-3-methyl-3-buten-2-one
- α-Ionone, isomethyl-
