Molecular formula
C15H22O

SMILES
C/C(=C\[C@@H]1CC[C@]2(C1C(=C)CCC2)C)/C=O

Fragrance
Green	53.13%
Woody	49.96%
Aldehydic	45.94%
Floral	43.83%
Fresh	40.77%
Sweet	38.15%
Fruity	35.18%
Citrus	35.18%
Ozone	34.97%
Fatty	33.5%

 

Flavor
Herbal	41.57%
Spice	40.17%
Woody	39.17%
Spicy	36.74%
Sweet	35.43%
Fresh	30.93%
Floral	27.37%
Mint	27.08%
Minty	26.67%
Wood	24.41%

 

Odor impact est.
Medium

XLogP3-AA
3.8

pKa est.
8.93 (weak base)

Molecular weight
218.33 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Ultra slow

Boiling point est.
320°C

Flash point

• 134.07 ˚C est.

• (E)-Opposita-4(15),7(11)-dien-12-al
• DNBAZHCMMBVLFT-KMZJMMDLSA-N

(E)-Opposita-4(15),7(11)-dien-12-al is viewed as a chemical intermediate with practical applications across several sectors, including fragrance manufacturing (fragrance intermediate) and as a precursor for flavor compounds used in food; in cosmetics and personal care it may serve as a fragrance component in formulations; in industrial manufacturing it can be used as the intermediate for the synthesis of specialty chemicals; in polymer/plastics technology it can serve as a starting material or precursor for specialty polymers and materials; and in coatings and inks it can be considered as an intermediate for formulation of paint and printer ink components.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	3221.58
methanol	3049.29
isopropanol	2851.59
water	0.62
ethyl acetate	4021.12
n-propanol	3200.48
acetone	3632.92
n-butanol	2799.62
acetonitrile	2538.74
DMF	3070.77
toluene	3738.87
isobutanol	2108.72
1,4-dioxane	4856.97
methyl acetate	2266.32
THF	6525.6
2-butanone	3053.27
n-pentanol	888.2
sec-butanol	1659.23
n-hexane	86.93
ethylene glycol	210.95
NMP	1291.92
cyclohexane	319.74
DMSO	1240.26
n-butyl acetate	1998.74
n-octanol	271.49
chloroform	5716.77
n-propyl acetate	1346.22
acetic acid	1025.81
dichloromethane	4624.51
cyclohexanone	3287.71
propylene glycol	418.44
isopropyl acetate	2631.11
DMAc	1395.88
2-ethoxyethanol	1286.78
isopentanol	2118.9
n-heptane	54.92
ethyl formate	1610.38
1,2-dichloroethane	3198.36
n-hexanol	1324.3
2-methoxyethanol	3399.04
isobutyl acetate	864.61
tetrachloromethane	804.29
n-pentyl acetate	819.72
transcutol	6850.5
n-heptanol	363.81
ethylbenzene	716.78
MIBK	1766.79
2-propoxyethanol	2571.44
tert-butanol	2291.85
MTBE	3194.09
2-butoxyethanol	898.12
propionic acid	1063.11
o-xylene	1008.79
formic acid	367.24
diethyl ether	4389.41
m-xylene	1779.12
p-xylene	722.88
chlorobenzene	2302.96
dimethyl carbonate	944.63
n-octane	16.08
formamide	803.38
cyclopentanone	3458.76
2-pentanone	3334.85
anisole	1472.2
cyclopentyl methyl ether	3214.67
gamma-butyrolactone	3124.54
1-methoxy-2-propanol	2754.98
pyridine	4082.21
3-pentanone	1902.1
furfural	2246.1
n-dodecane	11.06
diethylene glycol	1238.53
diisopropyl ether	980.25
tert-amyl alcohol	1350.95
acetylacetone	2521.81
n-hexadecane	14.0
acetophenone	942.22
methyl propionate	2480.42
isopentyl acetate	1780.11
trichloroethylene	5350.73
n-nonanol	234.37
cyclohexanol	1746.38
benzyl alcohol	969.92
2-ethylhexanol	592.18
isooctanol	316.87
dipropyl ether	962.93
1,2-dichlorobenzene	1529.44
ethyl lactate	412.07
propylene carbonate	1604.52
n-methylformamide	2087.75
2-pentanol	1539.82
n-pentane	179.58
1-propoxy-2-propanol	1665.96
1-methoxy-2-propyl acetate	2252.62
2-(2-methoxypropoxy) propanol	764.95
mesitylene	807.99
ε-caprolactone	2570.23
p-cymene	336.18
epichlorohydrin	4762.91
1,1,1-trichloroethane	2788.41
2-aminoethanol	797.92
morpholine-4-carbaldehyde	2234.42
sulfolane	1592.23
2,2,4-trimethylpentane	69.8
2-methyltetrahydrofuran	4213.12
n-hexyl acetate	952.49
isooctane	92.14
2-(2-butoxyethoxy)ethanol	1290.26
sec-butyl acetate	1063.82
tert-butyl acetate	2128.47
decalin	95.12
glycerin	465.25
diglyme	2597.62
acrylic acid	709.14
isopropyl myristate	295.36
n-butyric acid	2440.08
acetyl acetate	1514.66
di(2-ethylhexyl) phthalate	284.91
ethyl propionate	1175.44
nitromethane	1975.02
1,2-diethoxyethane	2626.11
benzonitrile	1629.95
trioctyl phosphate	173.03
1-bromopropane	2206.0
gamma-valerolactone	3854.46
n-decanol	157.34
triethyl phosphate	307.67
4-methyl-2-pentanol	843.27
propionitrile	2706.79
vinylene carbonate	1583.74
1,1,2-trichlorotrifluoroethane	1561.15
DMS	915.01
cumene	364.61
2-octanol	213.3
2-hexanone	1147.82
octyl acetate	338.17
limonene	425.79
1,2-dimethoxyethane	2255.08
ethyl orthosilicate	332.21
tributyl phosphate	268.57
diacetone alcohol	1568.08
N,N-dimethylaniline	701.42
acrylonitrile	2420.87
aniline	2802.43
1,3-propanediol	1588.79
bromobenzene	2524.73
dibromomethane	3091.4
1,1,2,2-tetrachloroethane	3601.69
2-methyl-cyclohexyl acetate	578.2
tetrabutyl urea	274.92
diisobutyl methanol	381.82
2-phenylethanol	1176.93
styrene	992.04
dioctyl adipate	364.12
dimethyl sulfate	709.28
ethyl butyrate	1039.41
methyl lactate	722.01
butyl lactate	556.15
diethyl carbonate	602.07
propanediol butyl ether	675.07
triethyl orthoformate	652.03
p-tert-butyltoluene	340.72
methyl 4-tert-butylbenzoate	619.36
morpholine	5955.93
tert-butylamine	1530.71
n-dodecanol	110.82
dimethoxymethane	3758.05
ethylene carbonate	1501.98
cyrene	499.49
2-ethoxyethyl acetate	1521.72
2-ethylhexyl acetate	1224.51
1,2,4-trichlorobenzene	1632.13
4-methylpyridine	4440.91
dibutyl ether	551.5
2,6-dimethyl-4-heptanol	381.82
DEF	2359.35
dimethyl isosorbide	1302.79
tetrachloroethylene	2208.78
eugenol	593.71
triacetin	734.69
span 80	535.36
1,4-butanediol	326.57
1,1-dichloroethane	3724.1
2-methyl-1-pentanol	788.7
methyl formate	1334.71
2-methyl-1-butanol	1710.09
n-decane	23.02
butyronitrile	2904.8
3,7-dimethyl-1-octanol	407.53
1-chlorooctane	187.78
1-chlorotetradecane	54.11
n-nonane	21.4
undecane	15.25
tert-butylcyclohexane	86.73
cyclooctane	94.27
cyclopentanol	1551.06
tetrahydropyran	6065.0
tert-amyl methyl ether	1398.92
2,5,8-trioxanonane	1321.63
1-hexene	488.69
2-isopropoxyethanol	875.97
2,2,2-trifluoroethanol	343.53
methyl butyrate	1414.14

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