Molecular formula
C16H14O

SMILES
CC1=CC=C(C=C1)C(=O)C=CC2=CC=CC=C2

Fragrance
Balsamic	76.09%
Floral	73.68%
Sweet	59.84%
Spicy	52.77%
Powdery	44.62%
Honey	44.27%
Cinnamon	43.21%
Fruity	41.36%
Cherry	37.66%
Herbal	35.08%

 

Flavor
Balsam	52.42%
Bitter	46.95%
Sweet	39.73%
Honey	38.88%
Cherry	32.58%
Cinnamon	29.43%
Apricot	27.66%
Rose	27.28%
Balsamic	26.68%
Powdery	26.31%

 

Odor impact est.
Medium

XLogP3-AA
3.4

pKa est.
7.09 (neutral)

Molecular weight
222.28 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Ultra slow

Boiling point est.
364°C

Flash point

• 162.14 ˚C est.

• 3-Phenyl-1-p-tolyl-propenone
• AKOS017085685

3-Phenyl-1-p-tolyl-propenone is primarily used as an organic synthesis intermediate, serving as a diaryl enone scaffold for the preparation of related chalcones, dyes and pigment precursors, as well as pharmaceutical leads. In perfumery, it is evaluated as an aroma intermediate due to its aromatic framework. In coatings and inks, it can act as a colorant precursor or functional building block for specialty dyes and formulations. In pharmaceutical and agrochemical development, it is used as a scaffold for chalcone-type compounds and related bioactive designs. In polymer and materials science, it may serve as a functionalized building block for specialty polymers and crosslinkable systems. Subject to local regulations and formulation limits.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	69.07
methanol	68.39
isopropanol	28.6
water	0.07
ethyl acetate	413.61
n-propanol	55.27
acetone	118.59
n-butanol	45.37
acetonitrile	190.27
DMF	190.47
toluene	181.25
isobutanol	29.66
1,4-dioxane	356.23
methyl acetate	289.52
THF	316.87
2-butanone	256.59
n-pentanol	36.95
sec-butanol	39.74
n-hexane	4.82
ethylene glycol	11.23
NMP	119.55
cyclohexane	6.39
DMSO	138.41
n-butyl acetate	170.01
n-octanol	15.17
chloroform	716.11
n-propyl acetate	175.87
acetic acid	80.71
dichloromethane	841.46
cyclohexanone	211.57
propylene glycol	24.15
isopropyl acetate	193.05
DMAc	361.03
2-ethoxyethanol	105.32
isopentanol	43.7
n-heptane	5.21
ethyl formate	98.24
1,2-dichloroethane	723.86
n-hexanol	43.04
2-methoxyethanol	148.28
isobutyl acetate	110.33
tetrachloromethane	23.64
n-pentyl acetate	65.85
transcutol	1006.16
n-heptanol	18.93
ethylbenzene	103.76
MIBK	125.85
2-propoxyethanol	120.9
tert-butanol	41.96
MTBE	98.54
2-butoxyethanol	64.38
propionic acid	80.05
o-xylene	72.77
formic acid	23.96
diethyl ether	220.32
m-xylene	75.31
p-xylene	89.2
chlorobenzene	214.83
dimethyl carbonate	131.88
n-octane	2.1
formamide	99.07
cyclopentanone	230.37
2-pentanone	180.22
anisole	288.34
cyclopentyl methyl ether	111.47
gamma-butyrolactone	294.76
1-methoxy-2-propanol	118.24
pyridine	525.09
3-pentanone	180.82
furfural	288.84
n-dodecane	2.03
diethylene glycol	76.35
diisopropyl ether	49.08
tert-amyl alcohol	46.04
acetylacetone	314.03
n-hexadecane	2.45
acetophenone	222.18
methyl propionate	266.79
isopentyl acetate	170.0
trichloroethylene	1254.9
n-nonanol	17.72
cyclohexanol	30.61
benzyl alcohol	104.46
2-ethylhexanol	36.69
isooctanol	20.38
dipropyl ether	94.46
1,2-dichlorobenzene	208.48
ethyl lactate	57.98
propylene carbonate	180.96
n-methylformamide	109.41
2-pentanol	32.99
n-pentane	2.62
1-propoxy-2-propanol	92.39
1-methoxy-2-propyl acetate	232.77
2-(2-methoxypropoxy) propanol	134.89
mesitylene	42.77
ε-caprolactone	217.0
p-cymene	39.8
epichlorohydrin	623.68
1,1,1-trichloroethane	303.63
2-aminoethanol	33.48
morpholine-4-carbaldehyde	241.07
sulfolane	230.43
2,2,4-trimethylpentane	4.49
2-methyltetrahydrofuran	170.99
n-hexyl acetate	84.55
isooctane	3.92
2-(2-butoxyethoxy)ethanol	173.77
sec-butyl acetate	148.52
tert-butyl acetate	189.58
decalin	10.86
glycerin	35.99
diglyme	439.65
acrylic acid	76.18
isopropyl myristate	44.62
n-butyric acid	109.81
acetyl acetate	216.78
di(2-ethylhexyl) phthalate	41.72
ethyl propionate	205.77
nitromethane	328.86
1,2-diethoxyethane	315.79
benzonitrile	154.48
trioctyl phosphate	20.84
1-bromopropane	209.51
gamma-valerolactone	342.68
n-decanol	14.59
triethyl phosphate	71.83
4-methyl-2-pentanol	28.48
propionitrile	145.2
vinylene carbonate	183.77
1,1,2-trichlorotrifluoroethane	235.57
DMS	169.07
cumene	53.11
2-octanol	11.84
2-hexanone	147.78
octyl acetate	46.08
limonene	48.45
1,2-dimethoxyethane	267.32
ethyl orthosilicate	67.84
tributyl phosphate	36.79
diacetone alcohol	141.02
N,N-dimethylaniline	130.15
acrylonitrile	223.31
aniline	128.54
1,3-propanediol	46.76
bromobenzene	256.85
dibromomethane	416.68
1,1,2,2-tetrachloroethane	783.01
2-methyl-cyclohexyl acetate	111.58
tetrabutyl urea	45.24
diisobutyl methanol	31.97
2-phenylethanol	94.83
styrene	147.91
dioctyl adipate	83.18
dimethyl sulfate	159.51
ethyl butyrate	168.03
methyl lactate	76.22
butyl lactate	53.19
diethyl carbonate	127.08
propanediol butyl ether	52.41
triethyl orthoformate	102.76
p-tert-butyltoluene	38.52
methyl 4-tert-butylbenzoate	114.08
morpholine	321.36
tert-butylamine	26.04
n-dodecanol	12.37
dimethoxymethane	255.84
ethylene carbonate	131.29
cyrene	93.77
2-ethoxyethyl acetate	163.61
2-ethylhexyl acetate	137.28
1,2,4-trichlorobenzene	245.65
4-methylpyridine	320.47
dibutyl ether	67.74
2,6-dimethyl-4-heptanol	31.97
DEF	210.61
dimethyl isosorbide	272.28
tetrachloroethylene	341.18
eugenol	107.01
triacetin	141.88
span 80	72.68
1,4-butanediol	16.04
1,1-dichloroethane	332.09
2-methyl-1-pentanol	51.85
methyl formate	86.43
2-methyl-1-butanol	41.14
n-decane	3.04
butyronitrile	105.92
3,7-dimethyl-1-octanol	31.85
1-chlorooctane	21.41
1-chlorotetradecane	9.99
n-nonane	2.52
undecane	2.4
tert-butylcyclohexane	10.59
cyclooctane	2.9
cyclopentanol	25.07
tetrahydropyran	212.75
tert-amyl methyl ether	89.23
2,5,8-trioxanonane	291.42
1-hexene	37.75
2-isopropoxyethanol	78.04
2,2,2-trifluoroethanol	33.35
methyl butyrate	209.94

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