Molecular formula
C12H16O2

SMILES
CCCOC(=O)C(C)C1=CC=CC=C1

Fragrance
Sweet	86.42%
Fruity	85.3%
Floral	80.88%
Honey	66.83%
Balsamic	60.5%
Rose	59.14%
Powdery	43.88%
Spicy	40.75%
Tropical	40.27%
Berry	37.04%

 

Flavor
Floral	72.97%
Rose	59.12%
Fruity	57.78%
Green	53.56%
Sweet	48.84%
Honey	46.24%
Waxy	42.58%
Tropical	41.98%
Balsam	33.82%
Bitter	31.07%

 

Odor impact est.
High

XLogP3-AA
3.2

pKa est.
7.12 (neutral)

Molecular weight
192.25 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Slow

Boiling point est.
244°C

Flash point

• 110.32 ˚C est.

• propyl hydratropate
• Propyl-alpha-phenyl propionate
• SCHEMBL4192926
• 2-phenyl-propionic acid propyl ester

Propyl hydratropate is used in perfumery and fragrances as a fragrance ingredient and potential fixative, and can be incorporated into cosmetics/personal care formulations to contribute aroma; it may act as a solvent or carrier for fragrance components in formulations, and as an intermediate in organic synthesis for industrial manufacturing; it can also be found in household products as a scent component and may serve as a processing aid in coatings, inks, and adhesives; its use is subject to local regulations and formulation limits.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	1786.31
methanol	2623.82
isopropanol	1177.99
water	1.84
ethyl acetate	1615.9
n-propanol	1307.9
acetone	2152.9
n-butanol	1298.78
acetonitrile	2351.59
DMF	2695.27
toluene	670.51
isobutanol	1035.44
1,4-dioxane	2186.68
methyl acetate	1408.66
THF	1393.2
2-butanone	1539.12
n-pentanol	898.54
sec-butanol	1015.58
n-hexane	128.8
ethylene glycol	232.62
NMP	1480.55
cyclohexane	206.59
DMSO	1565.53
n-butyl acetate	1435.48
n-octanol	451.28
chloroform	5217.56
n-propyl acetate	1094.49
acetic acid	1533.23
dichloromethane	5152.95
cyclohexanone	2044.89
propylene glycol	262.36
isopropyl acetate	876.49
DMAc	1818.07
2-ethoxyethanol	1015.64
isopentanol	1106.47
n-heptane	64.7
ethyl formate	1249.96
1,2-dichloroethane	3269.07
n-hexanol	894.37
2-methoxyethanol	1439.67
isobutyl acetate	632.48
tetrachloromethane	478.97
n-pentyl acetate	649.28
transcutol	2666.4
n-heptanol	376.78
ethylbenzene	471.1
MIBK	679.05
2-propoxyethanol	1106.82
tert-butanol	1212.02
MTBE	1205.13
2-butoxyethanol	630.61
propionic acid	978.03
o-xylene	405.64
formic acid	430.2
diethyl ether	1417.73
m-xylene	413.89
p-xylene	589.0
chlorobenzene	1370.46
dimethyl carbonate	477.76
n-octane	44.61
formamide	807.85
cyclopentanone	1673.86
2-pentanone	1258.95
anisole	970.39
cyclopentyl methyl ether	725.36
gamma-butyrolactone	1857.84
1-methoxy-2-propanol	866.12
pyridine	2125.95
3-pentanone	899.94
furfural	1760.35
n-dodecane	42.7
diethylene glycol	672.97
diisopropyl ether	303.64
tert-amyl alcohol	1059.81
acetylacetone	1142.26
n-hexadecane	48.88
acetophenone	837.93
methyl propionate	976.74
isopentyl acetate	1095.43
trichloroethylene	5342.53
n-nonanol	374.28
cyclohexanol	882.9
benzyl alcohol	734.9
2-ethylhexanol	495.59
isooctanol	318.0
dipropyl ether	508.59
1,2-dichlorobenzene	1166.09
ethyl lactate	371.56
propylene carbonate	1205.91
n-methylformamide	1332.19
2-pentanol	758.54
n-pentane	98.93
1-propoxy-2-propanol	712.54
1-methoxy-2-propyl acetate	780.78
2-(2-methoxypropoxy) propanol	531.81
mesitylene	256.88
ε-caprolactone	1516.28
p-cymene	220.78
epichlorohydrin	2463.31
1,1,1-trichloroethane	2129.31
2-aminoethanol	542.05
morpholine-4-carbaldehyde	1486.27
sulfolane	1534.81
2,2,4-trimethylpentane	63.71
2-methyltetrahydrofuran	1209.68
n-hexyl acetate	894.57
isooctane	48.67
2-(2-butoxyethoxy)ethanol	757.09
sec-butyl acetate	662.24
tert-butyl acetate	757.04
decalin	115.17
glycerin	335.77
diglyme	1444.84
acrylic acid	833.77
isopropyl myristate	297.45
n-butyric acid	1592.45
acetyl acetate	899.94
di(2-ethylhexyl) phthalate	252.04
ethyl propionate	807.65
nitromethane	2434.29
1,2-diethoxyethane	1111.96
benzonitrile	1196.95
trioctyl phosphate	191.65
1-bromopropane	1534.04
gamma-valerolactone	1996.3
n-decanol	265.93
triethyl phosphate	284.39
4-methyl-2-pentanol	398.29
propionitrile	1624.35
vinylene carbonate	1310.92
1,1,2-trichlorotrifluoroethane	1312.32
DMS	614.23
cumene	293.2
2-octanol	294.4
2-hexanone	991.73
octyl acetate	406.53
limonene	311.59
1,2-dimethoxyethane	1864.08
ethyl orthosilicate	273.73
tributyl phosphate	264.28
diacetone alcohol	678.32
N,N-dimethylaniline	541.62
acrylonitrile	1909.82
aniline	855.13
1,3-propanediol	850.53
bromobenzene	1519.86
dibromomethane	3166.88
1,1,2,2-tetrachloroethane	3793.13
2-methyl-cyclohexyl acetate	479.39
tetrabutyl urea	332.23
diisobutyl methanol	244.25
2-phenylethanol	633.25
styrene	711.88
dioctyl adipate	391.26
dimethyl sulfate	574.84
ethyl butyrate	800.61
methyl lactate	356.9
butyl lactate	440.09
diethyl carbonate	567.69
propanediol butyl ether	535.94
triethyl orthoformate	450.61
p-tert-butyltoluene	203.15
methyl 4-tert-butylbenzoate	500.46
morpholine	2164.76
tert-butylamine	810.56
n-dodecanol	194.11
dimethoxymethane	1237.44
ethylene carbonate	1110.36
cyrene	433.69
2-ethoxyethyl acetate	792.47
2-ethylhexyl acetate	792.6
1,2,4-trichlorobenzene	1124.5
4-methylpyridine	1984.72
dibutyl ether	575.14
2,6-dimethyl-4-heptanol	244.25
DEF	1542.45
dimethyl isosorbide	746.04
tetrachloroethylene	2309.98
eugenol	544.59
triacetin	597.9
span 80	443.18
1,4-butanediol	377.0
1,1-dichloroethane	2903.05
2-methyl-1-pentanol	834.08
methyl formate	1093.61
2-methyl-1-butanol	1064.51
n-decane	70.16
butyronitrile	1828.22
3,7-dimethyl-1-octanol	390.16
1-chlorooctane	340.52
1-chlorotetradecane	125.62
n-nonane	66.45
undecane	52.82
tert-butylcyclohexane	102.2
cyclooctane	51.95
cyclopentanol	707.26
tetrahydropyran	1795.1
tert-amyl methyl ether	760.88
2,5,8-trioxanonane	887.15
1-hexene	616.19
2-isopropoxyethanol	685.03
2,2,2-trifluoroethanol	430.96
methyl butyrate	1291.22

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