Molecular formula
C13H22O

SMILES
CCCCCCCC/C=C/C=C/C=O

Fragrance
Fatty	89.45%
Citrus	69.83%
Waxy	66.8%
Fruity	57.69%
Aldehydic	55.65%
Green	53.67%
Oily	51.08%
Orange	49.47%
Melon	42.03%
Cucumber	41.87%

 

Flavor
Citrus	52.61%
Fatty	52.07%
Orange	42.43%
Waxy	39.41%
Sweet	38.67%
Cucumber	38.37%
Melon	37.95%
Green	37.1%
Fat	35.4%
Wax	32.29%

 

Odor impact est.
High

XLogP3-AA
4.9

pKa est.
7.41 (neutral)

Molecular weight
194.31 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Ultra slow

Boiling point est.
281°C

Flash point

• 128.68 ˚C est.

• SCHEMBL229350

(2E,4E)-trideca-2,4-dienal is primarily used as a fragrance ingredient, functioning as an odorant and fragrance intermediate in perfumery. It may be employed in flavor/aroma formulations as an aroma chemical, contributing notes that can be green or aldehydic depending on the formulation. In cosmetics and personal care, it can appear as a fragrance component within scented products. In household products such as air fresheners and cleaners, it provides a distinctive scent as an additive. It also serves as an industrial intermediate for the synthesis of aroma compounds and related fragrances, acting as a building block in fragrance chemistry and potentially enabling polymer-related applications under controlled conditions.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	1726.41
methanol	1227.01
isopropanol	1686.64
water	0.01
ethyl acetate	2439.57
n-propanol	1600.35
acetone	3039.52
n-butanol	1518.15
acetonitrile	1016.83
DMF	1352.0
toluene	846.54
isobutanol	1092.07
1,4-dioxane	2100.96
methyl acetate	1242.27
THF	4369.49
2-butanone	2613.72
n-pentanol	1117.95
sec-butanol	1398.16
n-hexane	812.49
ethylene glycol	70.88
NMP	1016.99
cyclohexane	961.96
DMSO	2694.88
n-butyl acetate	2034.84
n-octanol	313.59
chloroform	2530.59
n-propyl acetate	1713.17
acetic acid	519.26
dichloromethane	3240.79
cyclohexanone	2885.84
propylene glycol	209.96
isopropyl acetate	1458.97
DMAc	911.14
2-ethoxyethanol	1046.46
isopentanol	1344.06
n-heptane	364.11
ethyl formate	635.03
1,2-dichloroethane	3089.46
n-hexanol	1224.54
2-methoxyethanol	1527.46
isobutyl acetate	919.87
tetrachloromethane	500.5
n-pentyl acetate	858.12
transcutol	4168.58
n-heptanol	361.43
ethylbenzene	454.51
MIBK	1327.74
2-propoxyethanol	1455.86
tert-butanol	1862.38
MTBE	2407.13
2-butoxyethanol	661.23
propionic acid	615.31
o-xylene	399.65
formic acid	64.9
diethyl ether	3624.81
m-xylene	523.24
p-xylene	464.48
chlorobenzene	838.26
dimethyl carbonate	224.24
n-octane	95.3
formamide	145.3
cyclopentanone	2500.19
2-pentanone	2687.46
anisole	697.22
cyclopentyl methyl ether	2541.69
gamma-butyrolactone	1830.89
1-methoxy-2-propanol	1516.92
pyridine	1818.88
3-pentanone	1479.62
furfural	1059.39
n-dodecane	41.73
diethylene glycol	523.1
diisopropyl ether	898.13
tert-amyl alcohol	1326.6
acetylacetone	1568.34
n-hexadecane	50.85
acetophenone	609.69
methyl propionate	1339.49
isopentyl acetate	1623.15
trichloroethylene	3476.04
n-nonanol	291.23
cyclohexanol	1342.48
benzyl alcohol	508.18
2-ethylhexanol	847.5
isooctanol	352.75
dipropyl ether	1959.42
1,2-dichlorobenzene	708.23
ethyl lactate	339.84
propylene carbonate	896.81
n-methylformamide	550.06
2-pentanol	1281.68
n-pentane	502.67
1-propoxy-2-propanol	1397.97
1-methoxy-2-propyl acetate	1276.92
2-(2-methoxypropoxy) propanol	532.71
mesitylene	350.27
ε-caprolactone	1731.01
p-cymene	278.08
epichlorohydrin	2877.17
1,1,1-trichloroethane	2159.37
2-aminoethanol	298.83
morpholine-4-carbaldehyde	1158.23
sulfolane	2020.4
2,2,4-trimethylpentane	141.83
2-methyltetrahydrofuran	3760.84
n-hexyl acetate	933.06
isooctane	137.98
2-(2-butoxyethoxy)ethanol	809.91
sec-butyl acetate	1079.24
tert-butyl acetate	1434.4
decalin	252.77
glycerin	203.45
diglyme	1654.62
acrylic acid	308.21
isopropyl myristate	327.7
n-butyric acid	1420.84
acetyl acetate	722.84
di(2-ethylhexyl) phthalate	201.85
ethyl propionate	1271.52
nitromethane	961.75
1,2-diethoxyethane	2413.43
benzonitrile	650.15
trioctyl phosphate	165.95
1-bromopropane	2698.04
gamma-valerolactone	2258.02
n-decanol	204.18
triethyl phosphate	336.34
4-methyl-2-pentanol	586.6
propionitrile	1143.76
vinylene carbonate	617.33
1,1,2-trichlorotrifluoroethane	1133.25
DMS	480.98
cumene	270.59
2-octanol	265.0
2-hexanone	1876.5
octyl acetate	357.35
limonene	587.18
1,2-dimethoxyethane	2140.06
ethyl orthosilicate	368.89
tributyl phosphate	242.37
diacetone alcohol	1134.13
N,N-dimethylaniline	408.54
acrylonitrile	908.82
aniline	734.26
1,3-propanediol	553.79
bromobenzene	998.28
dibromomethane	2599.59
1,1,2,2-tetrachloroethane	2822.17
2-methyl-cyclohexyl acetate	689.0
tetrabutyl urea	300.62
diisobutyl methanol	495.43
2-phenylethanol	555.67
styrene	599.68
dioctyl adipate	421.17
dimethyl sulfate	343.88
ethyl butyrate	1329.57
methyl lactate	301.16
butyl lactate	462.83
diethyl carbonate	572.48
propanediol butyl ether	437.57
triethyl orthoformate	723.47
p-tert-butyltoluene	267.31
methyl 4-tert-butylbenzoate	409.39
morpholine	3187.8
tert-butylamine	1382.09
n-dodecanol	152.8
dimethoxymethane	1468.89
ethylene carbonate	599.32
cyrene	382.81
2-ethoxyethyl acetate	1003.55
2-ethylhexyl acetate	1224.04
1,2,4-trichlorobenzene	745.21
4-methylpyridine	1681.36
dibutyl ether	1254.14
2,6-dimethyl-4-heptanol	495.43
DEF	1875.52
dimethyl isosorbide	943.03
tetrachloroethylene	1702.91
eugenol	361.86
triacetin	586.81
span 80	478.95
1,4-butanediol	200.71
1,1-dichloroethane	2886.01
2-methyl-1-pentanol	904.84
methyl formate	298.91
2-methyl-1-butanol	1133.07
n-decane	93.04
butyronitrile	1600.41
3,7-dimethyl-1-octanol	440.22
1-chlorooctane	389.05
1-chlorotetradecane	116.32
n-nonane	108.72
undecane	59.16
tert-butylcyclohexane	222.54
cyclooctane	257.24
cyclopentanol	1076.5
tetrahydropyran	4504.7
tert-amyl methyl ether	1466.42
2,5,8-trioxanonane	908.29
1-hexene	2062.51
2-isopropoxyethanol	839.74
2,2,2-trifluoroethanol	94.7
methyl butyrate	1662.92

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