| Identification | More | [Name]
2-Isopropyl-5-methyl-2-hexenal | [CAS]
35158-25-9 | [Synonyms]
2-ISOPROPYL-5-METHYL-2-HEXENAL
2-ISOPROPYL-5-METHYLHEX-2-ENAL
FEMA 3406
ISODIHYDRO LAVANDULAL
ISODIHYDROLAVANDULYL ALDEHYDE
(2E)-2-Isopropyl-5-methyl-2-hexenal
2-Hexen-1-al, 2-isopropyl-5-methyl-
2-Hexen-1-al, 5-methyl-2-(1-methylethyl)-
2-isopropyl-5-methyl-2-hexen-1-a
2-Isopropyl-5-methyl-2-hexen-1-al
5-methyl-2-(1-methylethyl)-2-hexen-1-a
5-methyl-2-(1-methylethyl)-2-hexena
5-methyl-2-(1-methylethyl)-2-Hexenal
METHYL JASMONATE 95+%
2-Hexenal, 5-methyl-2-(1-methylethyl)-
2-isopropyl-5-methyl-2-hexenal, cis + trans
2-ISOPROPYL-5-METHYL-HEXENE-1-AL
2-ISOPROPYL-5-METHYL-2-HEXENE-1-AL
Cacao aldehyde
5-Methyl-2-propan-2-ylhex-2-enal | [EINECS(EC#)]
252-406-4 | [Molecular Formula]
C10H18O | [MDL Number]
MFCD00036616 | [Molecular Weight]
154.25 | [MOL File]
35158-25-9.mol |
| Chemical Properties | Back Directory | [Boiling point ]
189 °C(lit.) | [density ]
0.845 g/mL at 25 °C(lit.)
| [FEMA ]
3406 | [refractive index ]
n20/D 1.452(lit.)
| [Fp ]
145 °F
| [storage temp. ]
-20°C, stored under nitrogen | [form ]
Liquid | [color ]
A colourless oily liquid | [Odor]
at 100.00 %. herbal lavender woody green blueberry tomato | [biological source]
synthetic | [Odor Type]
herbal | [Sensitive ]
Air Sensitive | [JECFA Number]
1215 | [BRN ]
1752384 | [Major Application]
flavors and fragrances | [Cosmetics Ingredients Functions]
PERFUMING | [InChI]
1S/C10H18O/c1-8(2)5-6-10(7-11)9(3)4/h6-9H,5H2,1-4H3 | [InChIKey]
IOLQAHFPDADCHJ-UHFFFAOYSA-N | [SMILES]
[H]C(=O)C(=CCC(C)C)C(C)C | [LogP]
3.35 | [CAS DataBase Reference]
35158-25-9(CAS DataBase Reference) | [NIST Chemistry Reference]
2-Isopropyl-5-methylhex-2-enal(35158-25-9) | [EPA Substance Registry System]
35158-25-9(EPA Substance) |
| Safety Data | Back Directory | [Hazard Codes ]
Xi | [Risk Statements ]
R10:Flammable.
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S16:Keep away from sources of ignition-No smoking .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing . | [RIDADR ]
1989 | [WGK Germany ]
2
| [RTECS ]
MP6450000
| [TSCA ]
Yes | [HazardClass ]
3 | [PackingGroup ]
III | [Storage Class]
10 - Combustible liquids | [Hazard Classifications]
Eye Irrit. 2
Skin Irrit. 2
Skin Sens. 1 | [Toxicity]
Both the acute oral LD50 value in rats and the acute dermal LD50 value in rabbits exceeded 5 g/kg |
| Hazard Information | Back Directory | [Description]
The derivatives are concrete and absolute. The concrete is prepared
in approximately 1.5 to 2.0% yields by solvent extraction (ben zene, petroleum ether) of the freshly cut flowering herb. It is a
dark-green, viscous mass. An absolute is obtained in approxi mately 45% yields by distillation of the concrete with diethylene
glycol. | [Chemical Properties]
2-Isopropyl-5-methyl-2-hexenal has a fruity, blueberry odor. | [Occurrence]
Reported found in cocoa | [Preparation]
By aldol condensation of isovaleraldehyde | [Aroma threshold values]
Aroma characteristics at 1.0%: woody, musty, nutshell-like, slightly floral and cooling with a honey and
cocoa creamy nuance. | [Taste threshold values]
Taste characteristics at 10 ppm: woody, nutshell, cocoa hulls, thiazole-like creamy nuance and a fresh, fruity
peachlike nuance. | [General Description]
2-Isopropyl-5-methyl-2-hexenal is a volatile aroma constituent of malted barley and roasted coffee beans. It can be formed via Maillard reaction between leucine and 3-methylbutanal. |
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