Molecular formula
C15H22O2

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

Fragrance
Floral	80.89%
Green	73.61%
Fruity	67.87%
Sweet	62.55%
Fresh	54.89%
Herbal	47.31%
Woody	41.15%
Balsamic	39.2%
Spicy	39.09%
Rose	34.29%

 

Flavor
Floral	65.9%
Sweet	61.82%
Herbal	52.83%
Green	50.48%
Rose	42.21%
Bitter	42.05%
Woody	40.72%
Fruity	39.53%
Tropical	37.69%
Spicy	36.64%

 

Odor impact est.
Medium

XLogP3-AA
4.0

pKa est.
8.4 (weak base)

Molecular weight
234.33 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Very slow

Boiling point est.
279°C

Flash point

• 142.59 ˚C est.

Chemical name: [2-methyl-3-(4-propan-2-ylphenyl)propyl] acetate. CAS number: In perfumery, this acetate is evaluated for use as a fragrance ingredient and possible fixative, contributing a woody, isopropylphenyl note and helping to stabilize complex accords. In cosmetics and personal care, it may serve as a fragrance ingredient within formulations such as creams and lotions. In household products and cleaners, it can be used as an odorant/fragrance additive to impart a lasting scent. In industrial manufacturing, it is often viewed as an intermediate for the synthesis of other fragrance compounds or as a specialty ingredient in fragrance-related processes. In coatings and inks, it may be used as a fragrance additive to provide scent in consumer-grade finishes.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	1025.96
methanol	985.23
isopropanol	766.65
water	0.18
ethyl acetate	1027.48
n-propanol	718.34
acetone	980.32
n-butanol	636.58
acetonitrile	655.22
DMF	840.57
toluene	295.78
isobutanol	456.05
1,4-dioxane	1553.58
methyl acetate	797.92
THF	1382.14
2-butanone	815.84
n-pentanol	518.57
sec-butanol	526.94
n-hexane	77.57
ethylene glycol	81.85
NMP	400.05
cyclohexane	52.98
DMSO	630.17
n-butyl acetate	607.32
n-octanol	146.14
chloroform	1674.7
n-propyl acetate	498.87
acetic acid	355.01
dichloromethane	1421.48
cyclohexanone	734.47
propylene glycol	198.91
isopropyl acetate	612.73
DMAc	874.81
2-ethoxyethanol	782.18
isopentanol	537.94
n-heptane	18.71
ethyl formate	340.71
1,2-dichloroethane	1023.08
n-hexanol	476.92
2-methoxyethanol	958.2
isobutyl acetate	405.36
tetrachloromethane	155.7
n-pentyl acetate	246.71
transcutol	1980.7
n-heptanol	148.37
ethylbenzene	191.39
MIBK	442.74
2-propoxyethanol	847.48
tert-butanol	829.04
MTBE	1111.59
2-butoxyethanol	323.18
propionic acid	330.92
o-xylene	180.94
formic acid	87.66
diethyl ether	1181.84
m-xylene	219.42
p-xylene	225.39
chlorobenzene	379.7
dimethyl carbonate	194.99
n-octane	12.8
formamide	151.93
cyclopentanone	710.43
2-pentanone	688.85
anisole	445.36
cyclopentyl methyl ether	595.68
gamma-butyrolactone	626.26
1-methoxy-2-propanol	806.62
pyridine	577.0
3-pentanone	471.42
furfural	538.5
n-dodecane	11.0
diethylene glycol	493.23
diisopropyl ether	246.75
tert-amyl alcohol	563.25
acetylacetone	657.0
n-hexadecane	12.96
acetophenone	328.2
methyl propionate	599.09
isopentyl acetate	540.65
trichloroethylene	1428.56
n-nonanol	134.04
cyclohexanol	377.19
benzyl alcohol	315.21
2-ethylhexanol	231.83
isooctanol	129.74
dipropyl ether	308.54
1,2-dichlorobenzene	337.1
ethyl lactate	183.69
propylene carbonate	390.02
n-methylformamide	302.6
2-pentanol	407.25
n-pentane	34.85
1-propoxy-2-propanol	540.95
1-methoxy-2-propyl acetate	587.3
2-(2-methoxypropoxy) propanol	331.37
mesitylene	127.69
ε-caprolactone	624.9
p-cymene	94.17
epichlorohydrin	1136.38
1,1,1-trichloroethane	816.29
2-aminoethanol	274.34
morpholine-4-carbaldehyde	750.02
sulfolane	553.66
2,2,4-trimethylpentane	29.12
2-methyltetrahydrofuran	982.81
n-hexyl acetate	360.5
isooctane	25.16
2-(2-butoxyethoxy)ethanol	487.06
sec-butyl acetate	413.68
tert-butyl acetate	610.22
decalin	47.83
glycerin	206.92
diglyme	891.63
acrylic acid	197.54
isopropyl myristate	134.5
n-butyric acid	550.23
acetyl acetate	427.45
di(2-ethylhexyl) phthalate	127.85
ethyl propionate	417.71
nitromethane	585.66
1,2-diethoxyethane	744.27
benzonitrile	317.04
trioctyl phosphate	83.02
1-bromopropane	631.68
gamma-valerolactone	973.17
n-decanol	102.29
triethyl phosphate	138.43
4-methyl-2-pentanol	235.91
propionitrile	477.53
vinylene carbonate	345.48
1,1,2-trichlorotrifluoroethane	557.39
DMS	323.08
cumene	132.32
2-octanol	103.13
2-hexanone	517.07
octyl acetate	169.48
limonene	137.93
1,2-dimethoxyethane	1151.08
ethyl orthosilicate	147.4
tributyl phosphate	121.22
diacetone alcohol	513.27
N,N-dimethylaniline	258.87
acrylonitrile	429.13
aniline	349.0
1,3-propanediol	428.09
bromobenzene	402.44
dibromomethane	946.44
1,1,2,2-tetrachloroethane	1308.05
2-methyl-cyclohexyl acetate	259.55
tetrabutyl urea	137.48
diisobutyl methanol	118.36
2-phenylethanol	322.2
styrene	238.02
dioctyl adipate	189.15
dimethyl sulfate	239.65
ethyl butyrate	343.16
methyl lactate	202.27
butyl lactate	194.6
diethyl carbonate	217.21
propanediol butyl ether	294.96
triethyl orthoformate	228.5
p-tert-butyltoluene	96.72
methyl 4-tert-butylbenzoate	238.73
morpholine	1707.51
tert-butylamine	453.49
n-dodecanol	76.78
dimethoxymethane	748.85
ethylene carbonate	329.59
cyrene	256.57
2-ethoxyethyl acetate	440.46
2-ethylhexyl acetate	391.64
1,2,4-trichlorobenzene	386.93
4-methylpyridine	652.29
dibutyl ether	262.1
2,6-dimethyl-4-heptanol	118.36
DEF	624.92
dimethyl isosorbide	476.21
tetrachloroethylene	700.88
eugenol	246.06
triacetin	323.95
span 80	253.39
1,4-butanediol	214.23
1,1-dichloroethane	1084.2
2-methyl-1-pentanol	431.07
methyl formate	214.21
2-methyl-1-butanol	447.12
n-decane	19.88
butyronitrile	536.87
3,7-dimethyl-1-octanol	174.59
1-chlorooctane	113.91
1-chlorotetradecane	41.94
n-nonane	19.19
undecane	14.17
tert-butylcyclohexane	50.62
cyclooctane	17.05
cyclopentanol	317.01
tetrahydropyran	1243.71
tert-amyl methyl ether	583.23
2,5,8-trioxanonane	543.92
1-hexene	381.29
2-isopropoxyethanol	588.34
2,2,2-trifluoroethanol	107.53
methyl butyrate	516.25

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