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W270733

Sigma-Aldrich

6-Methyl-5-hepten-2-one

greener alternative

natural, ≥98%, FCC

Sinónimos:

6-methylhept-5-en-2-one, Methyl heptenone

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About This Item

Fórmula lineal:
(CH3)2C=CHCH2CH2COCH3
Número de CAS:
110-93-0
Peso molecular:
126.20
FEMA Number:
2707
Beilstein/REAXYS Number:
1741705
EC Number:
203-816-7
Council of Europe no.:
149c
MDL number:
MFCD00008905
UNSPSC Code:
12164502
PubChem Substance ID:
24901276
Flavis number:
7.015
NACRES:
NA.21

grade

Fragrance grade
Kosher
natural

Quality Level

400

agency

follows IFRA guidelines
meets purity specifications of JECFA

reg. compliance

EU Regulation 1223/2009
FCC

assay

≥98%

greener alternative product characteristics

Less Hazardous Chemical Syntheses
Use of Renewable Feedstocks
Learn more about the Principles of Green Chemistry.

sustainability

Greener Alternative Product

refractive index

n20/D 1.439 (lit.)

bp

73 °C/18 mmHg (lit.)

density

0.858 g/mL at 20 °C
0.855 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

greener alternative category

Aligned,

organoleptic

apple; musty; fruity

SMILES string

C\C(C)=C\CCC(C)=O

InChI

1S/C8H14O/c1-7(2)5-4-6-8(3)9/h5H,4,6H2,1-3H3

InChI key

UHEPJGULSIKKTP-UHFFFAOYSA-N

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General description

6-Methyl-5-hepten-2-one is one of the main flavor volatile of tomatoes.
We are committed to bringing you Greener Alternative Products, which adhere to one of the four categories of Greener Alternatives . This product is a Biobased products, showing key improvements in Green Chemistry Principles “Less Hazardous Chemical Syntheses” and “Use of Renewable Feedstock”.

Disclaimer

For R&D or non-EU Food use. Not for retail sale.

pictograms

Flame
GHS02

signalword

Warning

hcodes

H226

Hazard Classifications

Flam. Liq. 3

Storage Class

3 - Flammable liquids

wgk_germany

WGK 1

flash_point_f

132.8 °F - closed cup

flash_point_c

56 °C - closed cup

ppe

Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)

Certificados de análisis (COA)

Busque Certificados de análisis (COA) introduciendo el número de lote del producto. Los números de lote se encuentran en la etiqueta del producto después de las palabras «Lot» o «Batch»

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Edna Pesis et al.
Journal of the science of food and agriculture, 90(12), 2114-2123 (2010-07-08)
Californian Granny Smith apples are very susceptible to bitter pit (BP) and superficial scald symptoms that develop during cold storage. The main preventive means are diphenylamine dipping and/or gaseous application of the ethylene inhibitor 1-methylcylclopropene (1-MCP), which is effective against
W A Wolken et al.
Journal of agricultural and food chemistry, 48(11), 5401-5405 (2000-11-23)
Under alkaline conditions, amino acids or proteins catalyze the deacetylation of citral, a major aroma component, resulting in methylheptenone and acetaldehyde formation. 3-Hydroxycitronellal is an intermediate in this reaction. Amino acids also catalyze the cis-trans isomerization of the pure isomers
Yohko Hanzawa et al.
Journal of oleo science, 61(11), 631-640 (2012-11-10)
3-hydroxy acids, 3-hydroxy-3,7-dimethyloct-6-enoic acid (1) and 3-hydroxy-2,2,3,7-tetramethyloct-6-enoic acid (2), were prepared from 6-methyl-5-hepten-2-one, and they were subsequently used to prepare (2,6,6-trimethyltetrahydropyran-2-yl)acetic acid (3) and 2-methyl-2-(2,6,6-trimethyltetrahydropyran-2-yl)propanoic acid (4), respectively, via cyclization with an acidic catalyst such as boron trifluoride diethyl etherate
W Reichardt
Canadian journal of microbiology, 27(1), 144-147 (1981-01-01)
Certain norcarotenoids, which have recently been found as excretion products of freshwater cyanobacteria and algae, are potent inhibitors of different metabolic functions in heterotrophic bacteria. 6-Methylhept-5-en-2-one showed the strongest effects and acted as a noncompetitive inhibitor of both glucose uptake
E Sprecher et al.
Antonie van Leeuwenhoek, 49(4-5), 493-499 (1983-11-01)
The accumulation of volatile metabolites in cultures of 34 strains comprising ten species of the genus Ceratocystis (Ascomycetes) has been investigated under defined culture conditions. The identified compounds include short-chain alcohols and esters, lower terpenes, terpenoids, and 2-phenylethyl acetate. Certain
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