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Merck
CN

W329002

3-Hexanone

≥97%

Synonym(s):

Ethyl propyl ketone

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About This Item

Linear Formula:
CH3CH2CH2COC2H5
CAS Number:
Molecular Weight:
100.16
FEMA Number:
3290
Council of Europe no.:
4125
UNSPSC Code:
12164502
PubChem Substance ID:
Flavis number:
7.096
EC Number:
209-645-4
NACRES:
NA.21
MDL number:
Beilstein/REAXYS Number:
1738025
Organoleptic:
fruity; waxy; sweet
Biological source:
synthetic
Food allergen:
no known allergens
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biological source

synthetic

Quality Level

assay

≥97%

refractive index

n20/D 1.400 (lit.)

bp

123 °C (lit.)

density

0.815 g/mL at 25 °C (lit.)

application(s)

flavors and fragrances

documentation

see Safety & Documentation for available documents

food allergen

no known allergens

organoleptic

fruity; waxy; sweet

SMILES string

CCCC(=O)CC

InChI

1S/C6H12O/c1-3-5-6(7)4-2/h3-5H2,1-2H3

InChI key

PFCHFHIRKBAQGU-UHFFFAOYSA-N

General description

3-Hexanone has been reported as one of the volatile organic compounds (VOCs) in pandan leaves, strawberry and acerola fruit.

Disclaimer

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


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pictograms

Flame

signalword

Danger

hcodes

pcodes

Hazard Classifications

Flam. Liq. 2

Storage Class

3 - Flammable liquids

wgk

WGK 3

flash_point_f

57.2 °F

flash_point_c

14 °C

ppe

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

Regulatory Information

危险化学品

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Volatile composition of pandan leaves (Pandanus amaryllifolius).
Flavor chemistry of ethnic foods, 105-109 (1999)
Metabolism of natural volatile compounds by strawberry fruit.
Hamilton-Kemp TR, et al.
Journal of Agricultural and Food Chemistry, 44(9), 2802-2805 (1996)
Volatile flavor constituents of acerola (Malpighia emarginata DC.) fruit.
Pino JA & Marbot R.
Journal of Agricultural and Food Chemistry, 49(12), 5880-5882 (2001)



Global Trade Item Number

SKUGTIN
W329002-SAMPLE04061837905865
W329002-1KG04061837905834
W329002-100G04061837905827
W329002-25G04061837905841