Molecular formula
C19H24O2

SMILES
CC(=CCCC(C)(C=C)OC(=O)C=CC1=CC=CC=C1)C

Fragrance
Sweet	79.42%
Floral	75.09%
Balsamic	70.65%
Fruity	56.49%
Rose	52.84%
Honey	44.2%
Spicy	43.21%
Woody	40.41%
Powdery	38.78%
Herbal	38.38%

 

Flavor
Bergamot	31.68%
Fruity	30.45%
Bitter	28.69%
Sweet	26.83%
Rose	26.31%
Woody	25.36%
Floral	23.55%
Balsam	22.85%
Heather	22.71%
Genet	22.57%

 

Odor impact est.
Medium

XLogP3-AA
5.4

pKa est.
7.44 (neutral)

Molecular weight
284.4 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Ultra slow

Boiling point est.
344°C

Flash point

• 170.08 ˚C est.

• 3,7-dimethylocta-1,6-dien-3-yl 3-phenylprop-2-enoate
• CHEMBL3185111
• DPFUEXLIKDHJNB-UHFFFAOYSA-N
• DB-056305
• G84792

3,7-Dimethylocta-1,6-dien-3-yl 3-phenylprop-2-enoate is an ester combining a terpenoid moiety with a cinnamate-like unit, typically considered a fragrance ingredient. Real-world applications include: (1) fragrance component and fixative in perfumery and cosmetics; (2) aroma additive in household products and cleaners; (3) a precursor or intermediate in the synthesis of fragrance compounds; (4) aroma additive for coatings, paints, and inks; (5) a building block for plastic and polymer processing in industrial manufacturing.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	537.72
methanol	460.12
isopropanol	287.87
water	0.03
ethyl acetate	731.11
n-propanol	394.64
acetone	355.88
n-butanol	370.46
acetonitrile	193.73
DMF	519.87
toluene	354.55
isobutanol	240.65
1,4-dioxane	763.17
methyl acetate	435.88
THF	1167.05
2-butanone	539.22
n-pentanol	302.75
sec-butanol	366.76
n-hexane	41.39
ethylene glycol	14.93
NMP	436.33
cyclohexane	59.35
DMSO	365.33
n-butyl acetate	451.39
n-octanol	100.64
chloroform	1637.25
n-propyl acetate	331.7
acetic acid	175.58
dichloromethane	1488.99
cyclohexanone	593.45
propylene glycol	61.17
isopropyl acetate	445.06
DMAc	929.51
2-ethoxyethanol	342.31
isopentanol	325.31
n-heptane	20.84
ethyl formate	189.89
1,2-dichloroethane	933.65
n-hexanol	307.61
2-methoxyethanol	451.89
isobutyl acetate	254.47
tetrachloromethane	89.94
n-pentyl acetate	207.18
transcutol	1679.68
n-heptanol	106.29
ethylbenzene	201.82
MIBK	325.12
2-propoxyethanol	511.34
tert-butanol	315.72
MTBE	579.44
2-butoxyethanol	224.78
propionic acid	158.12
o-xylene	174.89
formic acid	43.14
diethyl ether	766.52
m-xylene	210.03
p-xylene	217.78
chlorobenzene	404.51
dimethyl carbonate	158.54
n-octane	9.42
formamide	89.04
cyclopentanone	523.15
2-pentanone	479.45
anisole	430.91
cyclopentyl methyl ether	505.2
gamma-butyrolactone	493.14
1-methoxy-2-propanol	435.04
pyridine	546.78
3-pentanone	392.2
furfural	382.13
n-dodecane	9.88
diethylene glycol	215.0
diisopropyl ether	175.36
tert-amyl alcohol	360.92
acetylacetone	457.96
n-hexadecane	11.62
acetophenone	318.59
methyl propionate	455.87
isopentyl acetate	429.44
trichloroethylene	1402.74
n-nonanol	102.17
cyclohexanol	255.82
benzyl alcohol	240.19
2-ethylhexanol	187.66
isooctanol	96.04
dipropyl ether	255.93
1,2-dichlorobenzene	378.55
ethyl lactate	126.98
propylene carbonate	322.9
n-methylformamide	166.3
2-pentanol	278.08
n-pentane	30.18
1-propoxy-2-propanol	354.17
1-methoxy-2-propyl acetate	483.64
2-(2-methoxypropoxy) propanol	322.6
mesitylene	115.21
ε-caprolactone	520.39
p-cymene	92.77
epichlorohydrin	992.5
1,1,1-trichloroethane	586.88
2-aminoethanol	88.52
morpholine-4-carbaldehyde	520.04
sulfolane	476.6
2,2,4-trimethylpentane	28.29
2-methyltetrahydrofuran	817.62
n-hexyl acetate	308.31
isooctane	20.12
2-(2-butoxyethoxy)ethanol	439.52
sec-butyl acetate	311.8
tert-butyl acetate	429.0
decalin	45.89
glycerin	70.91
diglyme	746.78
acrylic acid	96.28
isopropyl myristate	129.81
n-butyric acid	325.54
acetyl acetate	322.15
di(2-ethylhexyl) phthalate	128.62
ethyl propionate	334.64
nitromethane	323.6
1,2-diethoxyethane	663.86
benzonitrile	232.21
trioctyl phosphate	77.43
1-bromopropane	615.42
gamma-valerolactone	658.98
n-decanol	77.27
triethyl phosphate	137.15
4-methyl-2-pentanol	159.07
propionitrile	236.07
vinylene carbonate	260.43
1,1,2-trichlorotrifluoroethane	382.84
DMS	280.03
cumene	125.5
2-octanol	73.1
2-hexanone	328.56
octyl acetate	159.3
limonene	150.12
1,2-dimethoxyethane	619.39
ethyl orthosilicate	143.77
tributyl phosphate	114.03
diacetone alcohol	340.11
N,N-dimethylaniline	277.39
acrylonitrile	208.1
aniline	276.84
1,3-propanediol	162.62
bromobenzene	462.29
dibromomethane	958.9
1,1,2,2-tetrachloroethane	1231.35
2-methyl-cyclohexyl acetate	266.74
tetrabutyl urea	151.8
diisobutyl methanol	101.21
2-phenylethanol	269.92
styrene	253.75
dioctyl adipate	199.8
dimethyl sulfate	190.12
ethyl butyrate	303.61
methyl lactate	133.43
butyl lactate	156.33
diethyl carbonate	197.7
propanediol butyl ether	183.38
triethyl orthoformate	216.03
p-tert-butyltoluene	91.84
methyl 4-tert-butylbenzoate	249.9
morpholine	984.31
tert-butylamine	201.23
n-dodecanol	57.65
dimethoxymethane	573.39
ethylene carbonate	245.62
cyrene	218.83
2-ethoxyethyl acetate	354.27
2-ethylhexyl acetate	347.16
1,2,4-trichlorobenzene	402.61
4-methylpyridine	626.76
dibutyl ether	223.25
2,6-dimethyl-4-heptanol	101.21
DEF	534.71
dimethyl isosorbide	559.66
tetrachloroethylene	585.54
eugenol	226.76
triacetin	304.22
span 80	240.33
1,4-butanediol	61.92
1,1-dichloroethane	761.88
2-methyl-1-pentanol	319.91
methyl formate	107.79
2-methyl-1-butanol	313.99
n-decane	16.73
butyronitrile	288.61
3,7-dimethyl-1-octanol	146.04
1-chlorooctane	99.78
1-chlorotetradecane	40.64
n-nonane	14.56
undecane	12.61
tert-butylcyclohexane	44.78
cyclooctane	17.22
cyclopentanol	186.5
tetrahydropyran	902.04
tert-amyl methyl ether	446.74
2,5,8-trioxanonane	532.71
1-hexene	220.69
2-isopropoxyethanol	276.83
2,2,2-trifluoroethanol	41.42
methyl butyrate	397.37

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