Molecular formula
C14H20O2

SMILES
CC(=O)C1=CC23[C@@](CCC[C@@]2(O3)C)(CC1)C

Fragrance
Woody	75.3%
Floral	61.29%
Fruity	61.27%
Berry	40.8%
Raspberry	37.9%
Orris	34.78%
Tobacco	34.2%
Powdery	33.25%
Cedar	32.65%
Amber	31.69%

 

Flavor
Fruity	51.27%
Sweet	44.0%
Woody	40.3%
Powdery	35.07%
Tobacco	34.67%
Floral	32.67%
Minty	32.5%
Earthy	28.75%
Spicy	28.67%
Herbal	27.94%

 

Odor impact est.
Medium

XLogP3-AA
1.9

pKa est.
8.65 (weak base)

Molecular weight
220.31 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Slow

Boiling point est.
286°C

Flash point

• 146.99 ˚C est.

• 13-nor-4,5-Epoxy-eudesm-6-en-11-one
• TWMMRCHAYIOZQQ-RFHHWMCGSA-N

Chemical name: 13-nor-4,5-Epoxy-eudesm-6-en-11-one. CAS number: In perfumery, this compound is primarily encountered as a fragrance-related odorant and as an intermediate in the synthesis of complex perfume components. In perfumery and cosmetics/personal care, it serves as an aroma contributor and may function as a fixing or modifying agent within fragrance formulations. It can also be encountered in household products such as air fresheners and cleaners where its odor profile is leveraged. In industrial manufacturing, the compound is evaluated as a building block for fragrance chemistry, enabling routes to novel terpenoid derivatives. Additionally, it is often studied as a chiral intermediate in synthetic routes to target aroma compounds, with use governed by formulation constraints and local regulations.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	62.5
methanol	86.7
isopropanol	55.15
water	0.65
ethyl acetate	103.47
n-propanol	56.54
acetone	114.04
n-butanol	53.86
acetonitrile	121.19
DMF	201.16
toluene	127.44
isobutanol	44.31
1,4-dioxane	254.81
methyl acetate	115.29
THF	321.89
2-butanone	110.67
n-pentanol	37.11
sec-butanol	39.9
n-hexane	3.25
ethylene glycol	22.87
NMP	184.17
cyclohexane	12.18
DMSO	101.16
n-butyl acetate	68.64
n-octanol	26.7
chloroform	378.24
n-propyl acetate	64.94
acetic acid	71.06
dichloromethane	308.01
cyclohexanone	172.12
propylene glycol	22.97
isopropyl acetate	78.27
DMAc	184.4
2-ethoxyethanol	75.15
isopentanol	51.64
n-heptane	3.98
ethyl formate	64.57
1,2-dichloroethane	133.19
n-hexanol	48.44
2-methoxyethanol	129.78
isobutyl acetate	56.67
tetrachloromethane	45.4
n-pentyl acetate	53.51
transcutol	230.82
n-heptanol	31.01
ethylbenzene	56.65
MIBK	70.9
2-propoxyethanol	118.22
tert-butanol	63.92
MTBE	66.28
2-butoxyethanol	70.76
propionic acid	58.2
o-xylene	71.15
formic acid	43.15
diethyl ether	67.26
m-xylene	80.02
p-xylene	78.75
chlorobenzene	133.59
dimethyl carbonate	69.97
n-octane	2.05
formamide	92.12
cyclopentanone	219.72
2-pentanone	85.62
anisole	125.13
cyclopentyl methyl ether	101.35
gamma-butyrolactone	208.98
1-methoxy-2-propanol	94.6
pyridine	237.33
3-pentanone	79.48
furfural	223.69
n-dodecane	2.65
diethylene glycol	108.25
diisopropyl ether	28.06
tert-amyl alcohol	44.65
acetylacetone	130.19
n-hexadecane	3.19
acetophenone	115.3
methyl propionate	94.85
isopentyl acetate	74.34
trichloroethylene	303.49
n-nonanol	28.57
cyclohexanol	55.93
benzyl alcohol	82.25
2-ethylhexanol	33.55
isooctanol	28.51
dipropyl ether	36.26
1,2-dichlorobenzene	122.01
ethyl lactate	42.28
propylene carbonate	112.08
n-methylformamide	97.78
2-pentanol	34.97
n-pentane	4.37
1-propoxy-2-propanol	72.11
1-methoxy-2-propyl acetate	105.44
2-(2-methoxypropoxy) propanol	81.99
mesitylene	46.38
ε-caprolactone	143.01
p-cymene	31.39
epichlorohydrin	239.27
1,1,1-trichloroethane	134.0
2-aminoethanol	39.67
morpholine-4-carbaldehyde	241.69
sulfolane	171.33
2,2,4-trimethylpentane	4.36
2-methyltetrahydrofuran	151.2
n-hexyl acetate	72.47
isooctane	4.14
2-(2-butoxyethoxy)ethanol	96.7
sec-butyl acetate	56.95
tert-butyl acetate	80.11
decalin	9.48
glycerin	42.34
diglyme	190.95
acrylic acid	60.14
isopropyl myristate	35.81
n-butyric acid	71.2
acetyl acetate	98.36
di(2-ethylhexyl) phthalate	43.23
ethyl propionate	68.31
nitromethane	165.57
1,2-diethoxyethane	85.16
benzonitrile	125.07
trioctyl phosphate	28.17
1-bromopropane	66.74
gamma-valerolactone	274.82
n-decanol	21.68
triethyl phosphate	40.22
4-methyl-2-pentanol	32.17
propionitrile	94.08
vinylene carbonate	141.05
1,1,2-trichlorotrifluoroethane	135.32
DMS	99.91
cumene	37.79
2-octanol	20.12
2-hexanone	68.76
octyl acetate	41.81
limonene	35.28
1,2-dimethoxyethane	161.16
ethyl orthosilicate	39.62
tributyl phosphate	33.51
diacetone alcohol	76.31
N,N-dimethylaniline	76.51
acrylonitrile	124.72
aniline	106.79
1,3-propanediol	60.14
bromobenzene	154.79
dibromomethane	164.73
1,1,2,2-tetrachloroethane	201.99
2-methyl-cyclohexyl acetate	68.0
tetrabutyl urea	43.4
diisobutyl methanol	26.0
2-phenylethanol	90.84
styrene	69.21
dioctyl adipate	50.75
dimethyl sulfate	89.46
ethyl butyrate	60.17
methyl lactate	54.4
butyl lactate	45.87
diethyl carbonate	49.84
propanediol butyl ether	56.63
triethyl orthoformate	49.83
p-tert-butyltoluene	31.14
methyl 4-tert-butylbenzoate	83.05
morpholine	223.26
tert-butylamine	40.94
n-dodecanol	17.12
dimethoxymethane	154.75
ethylene carbonate	107.76
cyrene	98.84
2-ethoxyethyl acetate	95.12
2-ethylhexyl acetate	61.15
1,2,4-trichlorobenzene	146.51
4-methylpyridine	214.07
dibutyl ether	31.05
2,6-dimethyl-4-heptanol	26.0
DEF	96.44
dimethyl isosorbide	152.91
tetrachloroethylene	129.47
eugenol	87.72
triacetin	92.48
span 80	61.26
1,4-butanediol	25.65
1,1-dichloroethane	132.13
2-methyl-1-pentanol	38.61
methyl formate	75.88
2-methyl-1-butanol	42.42
n-decane	4.07
butyronitrile	80.86
3,7-dimethyl-1-octanol	33.22
1-chlorooctane	19.48
1-chlorotetradecane	9.65
n-nonane	3.06
undecane	3.19
tert-butylcyclohexane	7.71
cyclooctane	4.79
cyclopentanol	65.61
tetrahydropyran	155.22
tert-amyl methyl ether	47.91
2,5,8-trioxanonane	134.81
1-hexene	16.01
2-isopropoxyethanol	61.97
2,2,2-trifluoroethanol	41.01
methyl butyrate	76.86

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