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67801-38-1

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67801-38-1 Structure

67801-38-1 Structure

Identification	Back Directory
[Name] IRITONE
[CAS] 67801-38-1
[Synonyms] IRITONE Brn 3243121 orris butenone Einecs 267-158-2 TRIMETHYL CYCLOHEXENYL BUTENONE 4-(2,4,6-trimethyl-3-cyclohexen-1-yl)-3-buten-2-on 4-(2,4,6-trimethyl-3-cyclohexen-1-yl)-3-Buten-2-one 4-(2,4,6-Trimethyl-4-cyclohexen-1-yl)-3-buten-2-one 3-Buten-2-one, 4-(2,4,6-trimethyl-3-cyclohexen-1-yl)-
[EINECS(EC#)] 267-158-2
[Molecular Formula] C13H20O
[MDL Number] MFCD00217012
[MOL File] 67801-38-1.mol
[Molecular Weight] 192.3

Chemical Properties	Back Directory
[Boiling point ] 287°C (estimate)
[density ] 0.9325 (rough estimate)
[refractive index ] 1.5335 (estimate)
[Odor] at 10.00 % in dipropylene glycol. velvety floral orris violet ionone woody
[Odor Type] floral
[Cosmetics Ingredients Functions] PERFUMING
[LogP] 3.642 (est)
[EPA Substance Registry System] 3-Buten-2-one, 4-(2,4,6-trimethyl-3-cyclohexen-1-yl)- (67801-38-1)

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[TSCA ] TSCA listed

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[Synthesis] 4-(2,4,6 -Trimethyl-3-cyclohexen-1 -yl)-3-buten-2-one from iso-Cyclocitral by condensation with Acetone. iso-Cyclocitral-S (= symmetric) yields the syrnmetnc isomer.

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