Molecular formula
C12H24O

SMILES
CC(C)/C(=C\CCC(C)CCO)/C

Fragrance
Floral	87.69%
Rose	65.97%
Citrus	58.39%
Waxy	56.43%
Fresh	56.12%
Sweet	54.82%
Green	53.88%
Lily	52.13%
Muguet	48.45%
Woody	45.65%

 

Flavor
Floral	59.92%
Citrus	51.65%
Waxy	50.12%
Fresh	44.17%
Green	37.53%
Rose	33.25%
Bitter	32.78%
Lily	31.56%
Oily	31.01%
Flower	30.11%

 

Odor impact est.
High

XLogP3-AA
4.0

pKa est.
10.07 (weak base)

Molecular weight
184.32 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Ultra slow

Boiling point est.
253°C

Flash point

• 104.07 ˚C est.

• dimethyl-[beta-Citronellol]

dimethyl-[beta-Citronellol] is typically used as an aroma ingredient and odor-modifying component in the fragrance industry, where it may serve as a fragrance fixative or as an intermediate for the synthesis of other aromatic compounds. In cosmetics and personal care, it can be used as a fragrance ingredient for perfumes and skin-care products. It may also be considered for applications in household and cleaning products as an aroma modifier, or as an intermediate in the production of polymers and coatings, depending on formulation needs and local regulations. CAS number:

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	4081.9
methanol	2353.64
isopropanol	4116.16
water	0.51
ethyl acetate	2124.34
n-propanol	3282.43
acetone	2118.12
n-butanol	3530.32
acetonitrile	1316.84
DMF	803.41
toluene	616.6
isobutanol	2295.68
1,4-dioxane	4066.85
methyl acetate	1239.03
THF	4339.77
2-butanone	1744.09
n-pentanol	1916.16
sec-butanol	2909.09
n-hexane	904.55
ethylene glycol	173.13
NMP	436.19
cyclohexane	1229.84
DMSO	932.07
n-butyl acetate	1787.7
n-octanol	633.31
chloroform	2133.73
n-propyl acetate	1134.93
acetic acid	957.17
dichloromethane	1423.28
cyclohexanone	1686.37
propylene glycol	474.19
isopropyl acetate	1258.48
DMAc	589.43
2-ethoxyethanol	1635.49
isopentanol	2626.13
n-heptane	543.99
ethyl formate	679.56
1,2-dichloroethane	1197.45
n-hexanol	2713.16
2-methoxyethanol	2365.63
isobutyl acetate	686.49
tetrachloromethane	587.06
n-pentyl acetate	728.4
transcutol	4045.24
n-heptanol	797.08
ethylbenzene	300.99
MIBK	995.62
2-propoxyethanol	2365.36
tert-butanol	4746.65
MTBE	4298.96
2-butoxyethanol	1058.99
propionic acid	774.53
o-xylene	343.05
formic acid	168.09
diethyl ether	4647.37
m-xylene	437.71
p-xylene	380.82
chlorobenzene	553.8
dimethyl carbonate	141.81
n-octane	135.82
formamide	245.78
cyclopentanone	1241.25
2-pentanone	1748.16
anisole	591.89
cyclopentyl methyl ether	1777.15
gamma-butyrolactone	1005.89
1-methoxy-2-propanol	1804.3
pyridine	1401.65
3-pentanone	984.62
furfural	745.85
n-dodecane	62.79
diethylene glycol	888.53
diisopropyl ether	1139.15
tert-amyl alcohol	2749.04
acetylacetone	955.28
n-hexadecane	72.13
acetophenone	372.79
methyl propionate	811.87
isopentyl acetate	1474.92
trichloroethylene	1472.86
n-nonanol	541.86
cyclohexanol	2001.67
benzyl alcohol	457.21
2-ethylhexanol	1237.77
isooctanol	604.66
dipropyl ether	2149.81
1,2-dichlorobenzene	409.93
ethyl lactate	278.95
propylene carbonate	592.66
n-methylformamide	460.8
2-pentanol	2394.38
n-pentane	877.86
1-propoxy-2-propanol	1929.32
1-methoxy-2-propyl acetate	1128.07
2-(2-methoxypropoxy) propanol	639.14
mesitylene	297.96
ε-caprolactone	1316.5
p-cymene	257.25
epichlorohydrin	1558.29
1,1,1-trichloroethane	1402.81
2-aminoethanol	670.12
morpholine-4-carbaldehyde	991.96
sulfolane	698.68
2,2,4-trimethylpentane	240.1
2-methyltetrahydrofuran	3269.57
n-hexyl acetate	895.12
isooctane	250.94
2-(2-butoxyethoxy)ethanol	1132.92
sec-butyl acetate	789.58
tert-butyl acetate	1314.46
decalin	245.32
glycerin	421.96
diglyme	1987.63
acrylic acid	375.72
isopropyl myristate	297.08
n-butyric acid	1943.48
acetyl acetate	664.02
di(2-ethylhexyl) phthalate	223.13
ethyl propionate	743.36
nitromethane	846.87
1,2-diethoxyethane	2225.01
benzonitrile	550.08
trioctyl phosphate	183.67
1-bromopropane	1623.06
gamma-valerolactone	1676.27
n-decanol	365.67
triethyl phosphate	265.19
4-methyl-2-pentanol	1126.91
propionitrile	1298.45
vinylene carbonate	468.85
1,1,2-trichlorotrifluoroethane	776.17
DMS	350.17
cumene	220.97
2-octanol	500.69
2-hexanone	1263.14
octyl acetate	354.53
limonene	536.5
1,2-dimethoxyethane	2579.91
ethyl orthosilicate	343.65
tributyl phosphate	234.69
diacetone alcohol	1071.54
N,N-dimethylaniline	325.85
acrylonitrile	792.62
aniline	798.48
1,3-propanediol	1493.12
bromobenzene	549.93
dibromomethane	1322.37
1,1,2,2-tetrachloroethane	1383.86
2-methyl-cyclohexyl acetate	593.8
tetrabutyl urea	246.22
diisobutyl methanol	674.1
2-phenylethanol	638.66
styrene	369.65
dioctyl adipate	344.06
dimethyl sulfate	152.85
ethyl butyrate	1083.96
methyl lactate	260.18
butyl lactate	446.98
diethyl carbonate	502.04
propanediol butyl ether	711.6
triethyl orthoformate	767.21
p-tert-butyltoluene	287.38
methyl 4-tert-butylbenzoate	389.9
morpholine	4826.51
tert-butylamine	3700.59
n-dodecanol	263.45
dimethoxymethane	978.08
ethylene carbonate	533.28
cyrene	356.51
2-ethoxyethyl acetate	849.56
2-ethylhexyl acetate	1068.28
1,2,4-trichlorobenzene	440.69
4-methylpyridine	1325.34
dibutyl ether	1179.61
2,6-dimethyl-4-heptanol	674.1
DEF	1102.74
dimethyl isosorbide	817.88
tetrachloroethylene	1021.74
eugenol	356.83
triacetin	507.58
span 80	676.62
1,4-butanediol	414.29
1,1-dichloroethane	1682.42
2-methyl-1-pentanol	1275.81
methyl formate	246.24
2-methyl-1-butanol	2108.07
n-decane	137.84
butyronitrile	1968.61
3,7-dimethyl-1-octanol	620.23
1-chlorooctane	404.46
1-chlorotetradecane	126.13
n-nonane	155.92
undecane	88.85
tert-butylcyclohexane	245.03
cyclooctane	306.99
cyclopentanol	1424.31
tetrahydropyran	5486.28
tert-amyl methyl ether	1904.4
2,5,8-trioxanonane	1018.07
1-hexene	1884.12
2-isopropoxyethanol	1135.9
2,2,2-trifluoroethanol	172.62
methyl butyrate	1000.96

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