Synonym: α-Irone; 4-(2,5,6,6-Tetramethyl-2-cyclohexen-1-yl)-3-buten-2-one; 4-(2,5,6,6-Tetramethyl-2-cyclohexen-1-yl)-3-butene-2-one; 6-Methyl-α-ionone; Methyl-α-ionone
CAS Number: 79-69-6
Empirical Formula (Hill Notation): C14H22O
Molecular Weight: 206.32
EC Number: 201-219-6
MDL Number: MFCD00042628
Linear Formula: C14H22O
Product Type: Chemical
assay |
≥90% (GC) |
density |
0.934 g/mL at 20 °C (lit.) |
grade |
technical |
InChI |
1S/C14H22O/c1-10-6-7-11(2)14(4,5)13(10)9-8-12(3)15/h6,8-9,11,13H,7H2,1-5H3/b9-8+ |
InChI key |
JZQOJFLIJNRDHK-CMDGGOBGSA-N |
Quality Level |
100 |
refractive index |
n20/D 1.492 |
SMILES string |
CC1CC=C(C)C(C=CC(C)=O)C1(C)C |
General description: |
Irone is a bioactive compound that is produced by an endophytic fungus in the rhizomes of Iris germanica. |
Packaging: |
5 mL in glass bottle |
RIDADR |
NONH for all modes of transport |
WGK Germany |
WGK 2 |
Flash Point(F) |
Not applicable |
Flash Point(C) |
Not applicable |
Purity |
≥90% (GC) |
Density |
0.934 g/mL at 20 °C (lit.) |
Refractive Index |
n20/D 1.492 |
UNSPSC |
12352115 |