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CAS 127-42-4

:

(1E)-1-[(1R)-2,6,6-Trimethyl-2-cyclohexen-1-yl]-1-penten-3-one

Description:
The chemical substance known as (1E)-1-[(1R)-2,6,6-trimethyl-2-cyclohexen-1-yl]-1-penten-3-one, with the CAS number 127-42-4, is an organic compound characterized by its complex structure, which includes a cyclohexene ring and a pentenone moiety. This compound features a conjugated system that contributes to its reactivity and potential applications in organic synthesis and fragrance chemistry. It is typically a colorless to pale yellow liquid with a distinctive odor, often associated with floral or fruity notes. The presence of multiple double bonds in its structure indicates that it may participate in various chemical reactions, such as addition or polymerization. Additionally, its stereochemistry, particularly the (1R) configuration, plays a crucial role in determining its biological activity and interaction with other molecules. This compound is of interest in the fields of perfumery and flavoring, as well as in the study of natural products and their derivatives. Safety data should be consulted for handling and usage, as with any chemical substance.
Formula:C14H22O
InChI:InChI=1S/C14H22O/c1-5-12(15)8-9-13-11(2)7-6-10-14(13,3)4/h7-9,13H,5-6,10H2,1-4H3/b9-8+/t13-/m0/s1
InChI key:InChIKey=VPKMGDRERYMTJX-XEHSLEBBSA-N
SMILES:C(=C/C(CC)=O)\[C@@H]1C(C)(C)CCC=C1C
Synonyms:
  • 1-Penten-3-one, 1-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, [R-(E)]-
  • Methyl-α-ionone
  • (+)-α-Methylionone
  • (1E)-1-[(1R)-2,6,6-Trimethyl-2-cyclohexen-1-yl]-1-penten-3-one
  • 1-Penten-3-one, 1-[(1R)-2,6,6-trimethyl-2-cyclohexen-1-yl]-, (1E)-
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