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W352403

3,5,5-Trimethylhexanal

≥95%, FG

Synonym(s):

Green hexanal

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About This Item

Linear Formula:
(CH3)3CCH2CH(CH3)CH2CHO
CAS Number:
5435-64-3
Molecular Weight:
142.24
FEMA Number:
3524
Council of Europe no.:
10384
UNSPSC Code:
12164502
PubChem Substance ID:
24901761
Flavis number:
5.116
EC Number:
226-603-0
NACRES:
NA.21
MDL number:
MFCD00010441
Organoleptic:
earthy
Grade:
FG, Fragrance grade, Halal, Kosher
Biological source:
synthetic
Agency:
follows IFRA guidelines
Food allergen:
no known allergens
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biological source

synthetic

Quality Segment

300, 400

grade

FG, Fragrance grade, Halal, Kosher

agency

follows IFRA guidelines

reg. compliance

EU Regulation 1223/2009, EU Regulation 1334/2008 & 178/2002

assay

≥95%

refractive index

n20/D 1.421 (lit.)

bp

67-68 °C/2.5 mmHg (lit.)

density

0.817 g/mL at 25 °C (lit.)

application(s)

flavors and fragrances

documentation

see Safety & Documentation for available documents

food allergen

no known allergens

fragrance allergen

no known allergens

organoleptic

earthy

SMILES string

CC(CC=O)CC(C)(C)C

InChI

1S/C9H18O/c1-8(5-6-10)7-9(2,3)4/h6,8H,5,7H2,1-4H3

InChI key

WTPYRCJDOZVZON-UHFFFAOYSA-N

General description

3,5,5-Trimethylhexanal is an aliphatic aldehyde mainly used as an internal standard to quantify the volatile aldehydes in the root tissues of plants.

Application


  • Analysis, occurrence and potential sensory significance of aliphatic aldehydes in white wines.: Culleré et al. (2011) explore the presence and sensory impact of aliphatic aldehydes, including 3,5,5-trimethylhexanal, in white wines. The study highlights the role of these compounds in contributing to the aroma and flavor profiles of wines, emphasizing their importance in food chemistry and sensory science (Culleré et al., 2011).

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pictograms

FlameExclamation mark
GHS02,GHS07

signalword

Warning

Hazard Classifications

Aquatic Chronic 3 - Flam. Liq. 3 - Skin Irrit. 2 - Skin Sens. 1

Storage Class

3 - Flammable liquids

flash_point_f

93.2 °F - closed cup

flash_point_c

34 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

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