| Identification | Back Directory | [Name]
BETA-IONOL | [CAS]
22029-76-1 | [Synonyms]
β-Ionol
FEMA 3625
BETA-IONOL
IONOL, BETA
beta-Ionol technical, >=90% (GC)
4-(2,6,6-Trimethylcyclohex-1-en-1-yl)
4-(2,6,6-TRIMETHYL-1-CYCLOHEXENYL)-3-BUTEN-2-OL
1-(1,3,3-Trimethylcyclohexene-2-yl)-1-butene-3-ol
4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-3-buten-2-o
4-(2,6,6-trimethyl-cyclohex-1-enyl)-but-3-en-2-ol
4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-3-buten-2-ol
But-3-en-2-ol, 4-(2,6,6-trimethyl-1-cyclohexenyl)-
3-Buten-2-ol, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-
(3E)-4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-3-buten-2-ol | [EINECS(EC#)]
244-735-7 | [Molecular Formula]
C13H22O | [MDL Number]
MFCD00036597 | [MOL File]
22029-76-1.mol | [Molecular Weight]
194.31 |
| Chemical Properties | Back Directory | [Boiling point ]
107 °C3 mm Hg(lit.)
| [density ]
0.928 g/mL at 20 °C(lit.)
| [FEMA ]
3625 | BETA-IONOL | [refractive index ]
n20/D 1.501
| [Fp ]
93.4 °C | [form ]
neat | [pka]
14.68±0.20(Predicted) | [Odor]
at 100.00 %. sweet herbal floral violet tropical balsam woody | [Odor Type]
floral | [JECFA Number]
392 | [BRN ]
1866761 | [Cosmetics Ingredients Functions]
PERFUMING | [InChI]
1S/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h7-8,11,14H,5-6,9H2,1-4H3/b8-7+ | [InChIKey]
CNOPDZWOYFOHGN-BQYQJAHWSA-N | [SMILES]
CC(O)\C=C\C1=C(C)CCCC1(C)C | [LogP]
4.33 | [EPA Substance Registry System]
3-Buten-2-ol, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)- (22029-76-1) |
| Questions And Answer | Back Directory | [limited use]
FEMA (mg/kg): 1.0 for non-alcoholic beverages; 1.5 for frozen dairy products, dairy products, fruit ice products, and imitation dairy products; 2.0 for gel products, puddings, confectionery, frosting, jam, and jelly; 2.5 for gummies ; Bakery 3.0; Hard Candy 4.0; Gum 5.0. |
| Safety Data | Back Directory | [Safety Statements ]
23-24/25 | [WGK Germany ]
2
| [RTECS ]
EM9630000
| [F ]
10-23 | [TSCA ]
TSCA listed | [Storage Class]
10 - Combustible liquids | [Toxicity]
rabbit,LD50,skin,> 5gm/kg (5000mg/kg),Food and Chemical Toxicology. Vol. 26, Pg. 361, 1988. |
| Hazard Information | Back Directory | [Description]
β-Ionol has a sweet, floral-balsamic warm odor. | [Chemical Properties]
β-Ionol has a sweet, floral-balsamic, warm odor. | [Uses]
β-Ionol can be used as food spice, suitable for the preparation of rose, lavender and other flavors. | [Definition]
ChEBI:Beta-Ionol is a sesquiterpenoid. | [Synthesis Reference(s)]
The Journal of Organic Chemistry, 37, p. 2992, 1972 DOI: 10.1021/jo00984a018 |
|
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