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Merck
CN

W352403

3,5,5-三甲基己醛

≥95%, FG

别名:

Green hexanal

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关于此项目

线性分子式:
(CH3)3CCH2CH(CH3)CH2CHO
化学文摘社编号:
分子量:
142.24
FEMA Number:
3524
Council of Europe no.:
10384
UNSPSC Code:
12164502
PubChem Substance ID:
Flavis number:
5.116
EC Number:
226-603-0
NACRES:
NA.21
MDL number:
Organoleptic:
earthy
Grade:
FG
Fragrance grade
Halal
Kosher
Biological source:
synthetic
Agency:
follows IFRA guidelines
Food allergen:
no known allergens
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产品名称

3,5,5-三甲基己醛, ≥95%, FG

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

biological source

synthetic

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

Quality Level

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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).

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.

pictograms

FlameExclamation mark

signalword

Warning

Hazard Classifications

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

存储类别

3 - Flammable liquids

wgk

WGK 1

flash_point_f

93.2 °F - closed cup

flash_point_c

34 °C - closed cup

ppe

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

法规信息

危险化学品
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历史批次信息供参考:

分析证书(COA)

Lot/Batch Number

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Foraging wireworms are attracted to root-produced volatile aldehydes.
Barsics F, et al.
Journal of pest science, 90(1), 69-76 (2017)
Barley (Hordeum distichon L.) roots synthesise volatile aldehydes with a strong age-dependent pattern and release (E)-non-2-enal and (E, Z)-nona-2, 6-dienal after mechanical injury.
Delory BM, et al.
Plant Physiology and Biochemistry, 104, 134-145 (2016)
Xinyi Zhang et al.
Journal of agricultural and food chemistry, 67(12), 3502-3510 (2019-02-28)
This work outlines a rapid novel methodology for the direct quantitation of 12 volatile aldehyde compounds related to oxidative off-flavors in wine, by measuring the combined free and hydrogen-sulfite-bound forms of each aldehyde compound, consisting of four general aldehydes, four

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