Molecular formula
C13H18O2

SMILES
CCCC1(OC2=CC=CC=C2O1)CCC

Fragrance
Sweet	46.98%
Spicy	42.6%
Fruity	40.85%
Floral	40.65%
Herbal	36.61%
Aromatic	28.17%
Creamy	26.24%
Phenolic	26.15%
Vanilla	25.3%
Animal	24.1%

 

Flavor
Sweet	51.75%
Earthy	42.57%
Green	36.11%
Musty	33.82%
Fruity	30.87%
Herbal	28.66%
Nutty	27.56%
Coconut	26.99%
Creamy	25.47%
Burnt	24.07%

 

Odor impact est.
Medium

XLogP3-AA
4.1

pKa est.
8.32 (weak base)

Molecular weight
206.28 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Slow

Boiling point est.
279°C

Flash point

• 102.73 ˚C est.

2,2-dipropyl-1,3-benzodioxole is commonly used as a chemical intermediate and aroma-related ingredient in fragrance, cosmetics, and household products. In perfumery, it may serve as an odorant or as a building block for fragrance formulations and personal care products. It may also be employed in household products such as air fresheners and detergents as a fragrance additive. In industrial manufacturing, it can function as an intermediate for the synthesis of specialty chemicals and as a precursor for certain polymer-related materials, subject to local regulations and formulation limits.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	686.48
methanol	713.62
isopropanol	543.35
water	1.39
ethyl acetate	1223.46
n-propanol	655.95
acetone	1344.39
n-butanol	651.55
acetonitrile	947.73
DMF	1655.4
toluene	908.72
isobutanol	603.1
1,4-dioxane	1596.95
methyl acetate	1076.73
THF	2216.62
2-butanone	1048.99
n-pentanol	577.45
sec-butanol	626.22
n-hexane	367.6
ethylene glycol	156.73
NMP	1815.44
cyclohexane	676.14
DMSO	1045.33
n-butyl acetate	1359.56
n-octanol	743.24
chloroform	6094.08
n-propyl acetate	983.24
acetic acid	993.01
dichloromethane	4853.64
cyclohexanone	2167.24
propylene glycol	226.01
isopropyl acetate	886.1
DMAc	1365.64
2-ethoxyethanol	609.01
isopentanol	621.14
n-heptane	256.09
ethyl formate	897.39
1,2-dichloroethane	2378.67
n-hexanol	799.22
2-methoxyethanol	826.96
isobutyl acetate	763.39
tetrachloromethane	978.92
n-pentyl acetate	1076.03
transcutol	1552.73
n-heptanol	469.24
ethylbenzene	646.18
MIBK	649.45
2-propoxyethanol	874.51
tert-butanol	576.25
MTBE	727.36
2-butoxyethanol	610.92
propionic acid	784.25
o-xylene	544.42
formic acid	225.13
diethyl ether	931.18
m-xylene	579.73
p-xylene	894.66
chlorobenzene	1669.35
dimethyl carbonate	716.11
n-octane	183.67
formamide	359.99
cyclopentanone	2149.01
2-pentanone	981.53
anisole	920.11
cyclopentyl methyl ether	1243.63
gamma-butyrolactone	2616.65
1-methoxy-2-propanol	657.32
pyridine	1894.67
3-pentanone	902.73
furfural	1821.38
n-dodecane	173.88
diethylene glycol	530.61
diisopropyl ether	380.25
tert-amyl alcohol	597.44
acetylacetone	1260.36
n-hexadecane	199.24
acetophenone	926.4
methyl propionate	988.11
isopentyl acetate	1138.43
trichloroethylene	4304.87
n-nonanol	620.97
cyclohexanol	934.8
benzyl alcohol	690.8
2-ethylhexanol	624.01
isooctanol	417.63
dipropyl ether	706.53
1,2-dichlorobenzene	1561.11
ethyl lactate	439.66
propylene carbonate	1881.15
n-methylformamide	748.99
2-pentanol	516.85
n-pentane	250.18
1-propoxy-2-propanol	658.99
1-methoxy-2-propyl acetate	944.08
2-(2-methoxypropoxy) propanol	632.88
mesitylene	406.39
ε-caprolactone	1945.78
p-cymene	424.04
epichlorohydrin	2125.11
1,1,1-trichloroethane	2252.18
2-aminoethanol	297.94
morpholine-4-carbaldehyde	1481.19
sulfolane	2308.25
2,2,4-trimethylpentane	148.05
2-methyltetrahydrofuran	1600.89
n-hexyl acetate	1641.0
isooctane	105.56
2-(2-butoxyethoxy)ethanol	783.02
sec-butyl acetate	693.35
tert-butyl acetate	777.76
decalin	308.4
glycerin	298.7
diglyme	1308.5
acrylic acid	735.43
isopropyl myristate	654.81
n-butyric acid	1100.66
acetyl acetate	1077.29
di(2-ethylhexyl) phthalate	518.29
ethyl propionate	873.83
nitromethane	1432.28
1,2-diethoxyethane	1000.59
benzonitrile	1330.2
trioctyl phosphate	430.21
1-bromopropane	1540.46
gamma-valerolactone	2024.99
n-decanol	465.01
triethyl phosphate	479.56
4-methyl-2-pentanol	347.1
propionitrile	872.44
vinylene carbonate	1734.97
1,1,2-trichlorotrifluoroethane	1262.72
DMS	1209.95
cumene	448.74
2-octanol	503.61
2-hexanone	830.79
octyl acetate	850.46
limonene	592.79
1,2-dimethoxyethane	1180.05
ethyl orthosilicate	439.96
tributyl phosphate	569.2
diacetone alcohol	564.81
N,N-dimethylaniline	637.76
acrylonitrile	1053.64
aniline	796.1
1,3-propanediol	474.01
bromobenzene	2138.85
dibromomethane	3343.29
1,1,2,2-tetrachloroethane	3449.59
2-methyl-cyclohexyl acetate	797.63
tetrabutyl urea	690.99
diisobutyl methanol	325.05
2-phenylethanol	748.64
styrene	859.76
dioctyl adipate	825.05
dimethyl sulfate	845.58
ethyl butyrate	919.79
methyl lactate	465.55
butyl lactate	659.88
diethyl carbonate	742.2
propanediol butyl ether	617.94
triethyl orthoformate	633.16
p-tert-butyltoluene	381.79
methyl 4-tert-butylbenzoate	762.68
morpholine	1423.38
tert-butylamine	481.14
n-dodecanol	380.19
dimethoxymethane	1083.48
ethylene carbonate	1624.08
cyrene	568.81
2-ethoxyethyl acetate	1031.48
2-ethylhexyl acetate	1029.24
1,2,4-trichlorobenzene	1641.68
4-methylpyridine	1813.72
dibutyl ether	989.35
2,6-dimethyl-4-heptanol	325.05
DEF	1199.72
dimethyl isosorbide	1049.34
tetrachloroethylene	2438.09
eugenol	725.82
triacetin	1105.26
span 80	674.15
1,4-butanediol	282.01
1,1-dichloroethane	2309.08
2-methyl-1-pentanol	583.51
methyl formate	758.32
2-methyl-1-butanol	620.16
n-decane	273.39
butyronitrile	1009.87
3,7-dimethyl-1-octanol	586.77
1-chlorooctane	832.28
1-chlorotetradecane	369.31
n-nonane	292.03
undecane	207.02
tert-butylcyclohexane	241.76
cyclooctane	255.67
cyclopentanol	980.23
tetrahydropyran	1658.35
tert-amyl methyl ether	609.74
2,5,8-trioxanonane	934.97
1-hexene	760.11
2-isopropoxyethanol	473.92
2,2,2-trifluoroethanol	419.37
methyl butyrate	1126.76

Scent© AI