Molecular formula
C16H24O2

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

Fragrance
Floral	69.9%
Green	66.85%
Fruity	66.62%
Sweet	64.39%
Balsamic	50.62%
Herbal	49.95%
Rose	48.14%
Waxy	47.63%
Oily	42.52%
Honey	41.05%

 

Flavor
Green	78.24%
Waxy	68.02%
Fruity	62.8%
Floral	56.17%
Sweet	48.77%
Rose	41.66%
Tropical	40.28%
Oily	38.59%
Wine	31.71%
Leaf	31.63%

 

Odor impact est.
Medium

XLogP3-AA
5.2

pKa est.
7.31 (neutral)

Molecular weight
248.36 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Ultra slow

Boiling point est.
301°C

Flash point

• 141.24 ˚C est.

• Hydratropic acid, heptyl ester
• SCHEMBL2294696
• KFKOTBBAYXQTPD-UHFFFAOYSA-N

Hydratropic acid, heptyl ester is used in fragrance development as a fragrance ingredient and fixative to help stabilize and extend aroma in perfumery; in cosmetics and personal care it can function as a fragrance carrier/solvent or contribute to formulation performance. In household products, it may be included as a scent component to impart a lasting aroma in cleaners and detergents, subject to regulatory limits. In industrial manufacturing, it is evaluated as an intermediate or processing aid for fragrance blends and as a component in coatings or inks where odor characteristics are desired. Its use is formulation- and regulation-dependent and not guaranteed across all markets.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	7109.51
methanol	9806.09
isopropanol	4353.52
water	0.47
ethyl acetate	9177.02
n-propanol	5566.79
acetone	11838.57
n-butanol	4500.75
acetonitrile	10541.24
DMF	9921.17
toluene	2616.77
isobutanol	3706.1
1,4-dioxane	6506.94
methyl acetate	6393.29
THF	5180.2
2-butanone	7471.72
n-pentanol	2331.98
sec-butanol	3406.06
n-hexane	315.61
ethylene glycol	328.33
NMP	5142.46
cyclohexane	717.29
DMSO	7303.29
n-butyl acetate	4699.7
n-octanol	646.69
chloroform	13101.27
n-propyl acetate	4601.93
acetic acid	3445.79
dichloromethane	17054.49
cyclohexanone	8593.36
propylene glycol	559.72
isopropyl acetate	4363.3
DMAc	5475.0
2-ethoxyethanol	2694.46
isopentanol	3311.74
n-heptane	106.83
ethyl formate	4070.22
1,2-dichloroethane	13387.73
n-hexanol	1918.83
2-methoxyethanol	4606.23
isobutyl acetate	2174.66
tetrachloromethane	1371.15
n-pentyl acetate	2163.38
transcutol	8131.99
n-heptanol	671.64
ethylbenzene	1119.14
MIBK	2687.15
2-propoxyethanol	2836.72
tert-butanol	3613.43
MTBE	5546.41
2-butoxyethanol	1424.45
propionic acid	3109.22
o-xylene	1187.36
formic acid	767.09
diethyl ether	8139.24
m-xylene	1282.63
p-xylene	1397.03
chlorobenzene	4068.64
dimethyl carbonate	1522.38
n-octane	54.03
formamide	2179.23
cyclopentanone	6789.35
2-pentanone	6561.9
anisole	2368.67
cyclopentyl methyl ether	3552.24
gamma-butyrolactone	6807.83
1-methoxy-2-propanol	3089.69
pyridine	7407.37
3-pentanone	4240.85
furfural	4441.47
n-dodecane	42.7
diethylene glycol	1322.6
diisopropyl ether	1272.95
tert-amyl alcohol	2882.15
acetylacetone	4844.9
n-hexadecane	52.79
acetophenone	2139.21
methyl propionate	4923.08
isopentyl acetate	3375.54
trichloroethylene	17294.45
n-nonanol	540.76
cyclohexanol	3320.97
benzyl alcohol	1548.33
2-ethylhexanol	1053.66
isooctanol	584.67
dipropyl ether	1682.46
1,2-dichlorobenzene	3257.5
ethyl lactate	899.98
propylene carbonate	3522.7
n-methylformamide	5263.89
2-pentanol	2493.68
n-pentane	253.3
1-propoxy-2-propanol	2001.53
1-methoxy-2-propyl acetate	2579.98
2-(2-methoxypropoxy) propanol	989.2
mesitylene	703.92
ε-caprolactone	6142.7
p-cymene	441.44
epichlorohydrin	9387.38
1,1,1-trichloroethane	7782.59
2-aminoethanol	1287.24
morpholine-4-carbaldehyde	4129.64
sulfolane	5954.64
2,2,4-trimethylpentane	137.29
2-methyltetrahydrofuran	5296.41
n-hexyl acetate	2251.73
isooctane	101.43
2-(2-butoxyethoxy)ethanol	1619.67
sec-butyl acetate	2486.39
tert-butyl acetate	3095.69
decalin	254.79
glycerin	593.75
diglyme	3676.27
acrylic acid	2007.71
isopropyl myristate	620.51
n-butyric acid	5775.8
acetyl acetate	3327.46
di(2-ethylhexyl) phthalate	471.51
ethyl propionate	3482.66
nitromethane	9002.46
1,2-diethoxyethane	4069.0
benzonitrile	2810.0
trioctyl phosphate	344.38
1-bromopropane	6595.17
gamma-valerolactone	7509.69
n-decanol	356.49
triethyl phosphate	658.58
4-methyl-2-pentanol	1045.09
propionitrile	6123.62
vinylene carbonate	3196.35
1,1,2-trichlorotrifluoroethane	3664.53
DMS	1729.94
cumene	592.04
2-octanol	494.31
2-hexanone	3592.07
octyl acetate	814.21
limonene	776.64
1,2-dimethoxyethane	5403.16
ethyl orthosilicate	642.8
tributyl phosphate	525.5
diacetone alcohol	2155.43
N,N-dimethylaniline	1136.72
acrylonitrile	6378.67
aniline	2875.27
1,3-propanediol	2157.29
bromobenzene	4609.46
dibromomethane	10387.1
1,1,2,2-tetrachloroethane	12523.45
2-methyl-cyclohexyl acetate	1218.97
tetrabutyl urea	689.76
diisobutyl methanol	500.77
2-phenylethanol	1302.31
styrene	1876.9
dioctyl adipate	824.15
dimethyl sulfate	1839.61
ethyl butyrate	2518.58
methyl lactate	1119.02
butyl lactate	1202.44
diethyl carbonate	1392.35
propanediol butyl ether	1034.35
triethyl orthoformate	1187.62
p-tert-butyltoluene	385.86
methyl 4-tert-butylbenzoate	1061.03
morpholine	8618.12
tert-butylamine	2202.57
n-dodecanol	253.34
dimethoxymethane	4833.18
ethylene carbonate	3138.41
cyrene	873.83
2-ethoxyethyl acetate	2752.51
2-ethylhexyl acetate	2366.75
1,2,4-trichlorobenzene	3264.89
4-methylpyridine	7236.59
dibutyl ether	1550.63
2,6-dimethyl-4-heptanol	500.77
DEF	7174.75
dimethyl isosorbide	1667.93
tetrachloroethylene	7484.71
eugenol	1082.17
triacetin	1528.29
span 80	842.94
1,4-butanediol	773.59
1,1-dichloroethane	11703.88
2-methyl-1-pentanol	1985.89
methyl formate	3156.45
2-methyl-1-butanol	3407.66
n-decane	78.99
butyronitrile	6475.68
3,7-dimethyl-1-octanol	688.01
1-chlorooctane	619.54
1-chlorotetradecane	183.85
n-nonane	75.77
undecane	54.73
tert-butylcyclohexane	203.47
cyclooctane	133.01
cyclopentanol	2563.07
tetrahydropyran	8623.93
tert-amyl methyl ether	2772.39
2,5,8-trioxanonane	1889.15
1-hexene	1830.86
2-isopropoxyethanol	1794.44
2,2,2-trifluoroethanol	941.99
methyl butyrate	5455.88

Scent© AI