Molecular formula
C15H24O

SMILES
C[C@@]12CC[C@@H]3[C@H](CC3(C)C)C(=C)CC[C@@H]1O2

Retention indicies (RI)

• DB5: 1555.0
• Carbowax: 1981.33

Woody	83.22%
Amber	49.33%
Sweet	49.28%
Cedar	48.65%
Spicy	48.42%
Dry	47.01%
Fresh	41.95%
Tobacco	38.61%
Camphoreous	37.15%
Earthy	36.41%

Scent© AI

XLogP3-AA
3.6

Molecular weight
220.35 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Slow

Boiling point est.
290°C

Flash point est.
102.41 ˚C

• isocaryophyllene oxide
• CHEMBL399036
• SCHEMBL24110084
• NVEQFIOZRFFVFW-GUIRCDHDSA-N
• Q67879947

Solvent	Solubility (g/L)
ethanol	258.93
methanol	199.75
isopropanol	232.43
water	0.98
ethyl acetate	273.32
n-propanol	221.58
acetone	266.46
n-butanol	225.18
acetonitrile	242.32
DMF	231.73
toluene	287.96
isobutanol	172.84
1,4-dioxane	595.99
methyl acetate	250.5
THF	780.65
2-butanone	268.14
n-pentanol	158.76
sec-butanol	166.54
n-hexane	27.67
ethylene glycol	52.26
NMP	203.77
cyclohexane	71.69
DMSO	176.1
n-butyl acetate	297.12
n-octanol	129.16
chloroform	807.36
n-propyl acetate	212.08
acetic acid	183.98
dichloromethane	603.47
cyclohexanone	359.4
propylene glycol	90.7
isopropyl acetate	237.36
DMAc	235.29
2-ethoxyethanol	234.95
isopentanol	202.84
n-heptane	41.76
ethyl formate	185.72
1,2-dichloroethane	281.91
n-hexanol	241.58
2-methoxyethanol	340.02
isobutyl acetate	197.89
tetrachloromethane	127.24
n-pentyl acetate	199.32
transcutol	886.93
n-heptanol	133.67
ethylbenzene	149.37
MIBK	202.4
2-propoxyethanol	384.1
tert-butanol	220.67
MTBE	236.85
2-butoxyethanol	246.9
propionic acid	153.08
o-xylene	162.26
formic acid	61.15
diethyl ether	245.66
m-xylene	201.36
p-xylene	203.1
chlorobenzene	271.37
dimethyl carbonate	115.57
n-octane	17.69
formamide	101.02
cyclopentanone	387.6
2-pentanone	232.5
anisole	267.99
cyclopentyl methyl ether	282.09
gamma-butyrolactone	373.85
1-methoxy-2-propanol	290.87
pyridine	423.87
3-pentanone	178.88
furfural	361.05
n-dodecane	17.42
diethylene glycol	268.5
diisopropyl ether	109.65
tert-amyl alcohol	155.76
acetylacetone	298.43
n-hexadecane	20.36
acetophenone	231.43
methyl propionate	195.52
isopentyl acetate	313.9
trichloroethylene	540.49
n-nonanol	121.07
cyclohexanol	189.75
benzyl alcohol	203.78
2-ethylhexanol	156.01
isooctanol	114.66
dipropyl ether	195.27
1,2-dichlorobenzene	240.82
ethyl lactate	114.1
propylene carbonate	264.59
n-methylformamide	136.87
2-pentanol	156.71
n-pentane	34.56
1-propoxy-2-propanol	299.89
1-methoxy-2-propyl acetate	354.99
2-(2-methoxypropoxy) propanol	253.9
mesitylene	129.31
ε-caprolactone	328.1
p-cymene	127.23
epichlorohydrin	459.61
1,1,1-trichloroethane	288.52
2-aminoethanol	110.84
morpholine-4-carbaldehyde	356.85
sulfolane	271.67
2,2,4-trimethylpentane	23.48
2-methyltetrahydrofuran	422.31
n-hexyl acetate	264.14
isooctane	25.56
2-(2-butoxyethoxy)ethanol	328.79
sec-butyl acetate	184.89
tert-butyl acetate	241.98
decalin	40.86
glycerin	113.74
diglyme	582.77
acrylic acid	127.94
isopropyl myristate	125.96
n-butyric acid	224.95
acetyl acetate	219.54
di(2-ethylhexyl) phthalate	129.26
ethyl propionate	180.73
nitromethane	257.43
1,2-diethoxyethane	344.17
benzonitrile	286.28
trioctyl phosphate	93.09
1-bromopropane	214.11
gamma-valerolactone	543.63
n-decanol	91.52
triethyl phosphate	112.97
4-methyl-2-pentanol	130.38
propionitrile	228.38
vinylene carbonate	282.06
1,1,2-trichlorotrifluoroethane	281.89
DMS	212.4
cumene	111.71
2-octanol	91.37
2-hexanone	209.96
octyl acetate	143.38
limonene	144.44
1,2-dimethoxyethane	413.42
ethyl orthosilicate	114.27
tributyl phosphate	107.85
diacetone alcohol	209.96
N,N-dimethylaniline	166.48
acrylonitrile	233.77
aniline	233.96
1,3-propanediol	191.75
bromobenzene	295.91
dibromomethane	398.46
1,1,2,2-tetrachloroethane	424.49
2-methyl-cyclohexyl acetate	214.87
tetrabutyl urea	125.21
diisobutyl methanol	118.67
2-phenylethanol	250.91
styrene	173.74
dioctyl adipate	166.46
dimethyl sulfate	121.48
ethyl butyrate	217.52
methyl lactate	120.23
butyl lactate	170.37
diethyl carbonate	164.41
propanediol butyl ether	217.98
triethyl orthoformate	187.9
p-tert-butyltoluene	126.16
methyl 4-tert-butylbenzoate	194.85
morpholine	539.92
tert-butylamine	166.96
n-dodecanol	73.64
dimethoxymethane	286.3
ethylene carbonate	250.48
cyrene	199.39
2-ethoxyethyl acetate	286.06
2-ethylhexyl acetate	255.25
1,2,4-trichlorobenzene	266.15
4-methylpyridine	409.5
dibutyl ether	165.6
2,6-dimethyl-4-heptanol	118.67
DEF	199.6
dimethyl isosorbide	391.19
tetrachloroethylene	265.95
eugenol	197.43
triacetin	260.87
span 80	222.67
1,4-butanediol	82.91
1,1-dichloroethane	321.93
2-methyl-1-pentanol	149.95
methyl formate	121.42
2-methyl-1-butanol	163.55
n-decane	27.78
butyronitrile	257.0
3,7-dimethyl-1-octanol	152.65
1-chlorooctane	90.29
1-chlorotetradecane	44.16
n-nonane	24.53
undecane	21.35
tert-butylcyclohexane	36.23
cyclooctane	30.37
cyclopentanol	193.94
tetrahydropyran	496.45
tert-amyl methyl ether	158.81
2,5,8-trioxanonane	372.12
1-hexene	94.64
2-isopropoxyethanol	191.22
2,2,2-trifluoroethanol	81.64
methyl butyrate	212.97

Scent© AI