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Table 1 Key aroma compounds, chemical structure, predicted log P and K a/w and literature odour threshold (above an aqueous solution)

From: Discrimination of roast and ground coffee aroma

Compound

Structure

Log P

 Ka/w

Odour threshold

E, E-2, 4-Decadienal

3.33

0.008994

0.07 ppb[23]

25152-84-5

    

2,3-Pentanedione

−0.85

1.07E-05

20 ppb[24]

600-14-6

    

2-Acetylpyrazine

−0.38

2.17E-07

62 ppb[23]

22047-25-2

    

2-Acetylpyridine

1122-62-9

n/a

n/a

n/a

2-Ethyl-3,6-dimethylpyrazine

n/a

n/a

8.6 ppb[23]

13360-65-1

    

2-Methylbutanal

1.23

0.0065

0.9 ppb[23]

96-17-3

    

3-Methylbutanal

1.23

0.0065

0.17 ppb[23]

590-86-3

    

2-Methylbutanoic acid

n/a

n/a

740 ppb[25]

1169-53-0

    

3-Methylbutanoic acid

1.49

5.23E-05

540 ppb[25]

503-74-2

    

Furfural

0.83

0.000548

3000 ppb[24]

98-01-1

    

Furfurylmethylsulphide

n/a

n/a

n/a

1438-91-1

    

Guaiacol

1.34

1.36E-06

3 ppb[23]

90-05-1

    

Maltol

−0.19

0.000267

20 ppm[23]

118-71-8

    

Phenylacetaldehyde

1.54

0.000224

4 ppb[24]

122-78-1

    

Trimethylpyrazine

1.58

0.00016

9 ppm[23]

14667-55-1

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