Molecular formula
C15H18O

SMILES
C[C@H]1CCC2=C(C1)C3=C(C=C2C)OC=C3C

Fragrance
Sweet	57.27%
Musk	41.11%
Animal	37.37%
Phenolic	35.11%
Leathery	35.06%
Woody	33.64%
Spicy	32.7%
Powdery	30.81%
Dry	29.96%
Musty	29.78%

 

Flavor
Bitter	34.09%
Musty	28.27%
Earthy	27.8%
Animal	23.31%
Flat	23.05%
Very strong	22.81%
Indole	22.76%
Soybean	21.87%
Eugenol	21.79%
Parsley	21.43%

 

Odor impact est.
Medium

XLogP3-AA
4.7

pKa est.
8.06 (weak base)

Molecular weight
214.3 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Ultra slow

Boiling point est.
356°C

Flash point

• 154.0 ˚C est.

• AKOS032948988

The compound (8S)-1,5,8-trimethyl-6,7,8,9-tetrahydrobenzo[e][1]benzofuran (CAS number: ) is typically considered a useful intermediate in organic synthesis and may have practical applications across several industries. In perfumery and cosmetics, it could serve as an odorant or fragrance-building block; in pharmaceuticals, it may function as a chiral building block for synthesis of complex intermediates; in industrial manufacturing and polymers, it may be evaluated as a specialty building block for downstream polymer or material formulations; and in coatings and inks, it could act as a reactive intermediate or precursor for functional materials. These roles depend on formulation conditions, regulatory requirements, and specific limits of use.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	314.46
methanol	189.54
isopropanol	252.07
water	0.04
ethyl acetate	541.58
n-propanol	343.59
acetone	745.29
n-butanol	364.68
acetonitrile	267.38
DMF	1063.44
toluene	982.91
isobutanol	282.45
1,4-dioxane	1407.43
methyl acetate	561.94
THF	2163.13
2-butanone	891.1
n-pentanol	276.26
sec-butanol	242.76
n-hexane	70.08
ethylene glycol	24.33
NMP	714.69
cyclohexane	174.31
DMSO	310.73
n-butyl acetate	730.98
n-octanol	173.36
chloroform	2281.72
n-propyl acetate	418.5
acetic acid	147.94
dichloromethane	2405.38
cyclohexanone	1463.35
propylene glycol	48.31
isopropyl acetate	359.93
DMAc	619.61
2-ethoxyethanol	254.87
isopentanol	321.86
n-heptane	83.07
ethyl formate	405.04
1,2-dichloroethane	1230.67
n-hexanol	466.07
2-methoxyethanol	352.86
isobutyl acetate	394.21
tetrachloromethane	304.61
n-pentyl acetate	448.02
transcutol	669.65
n-heptanol	195.81
ethylbenzene	382.28
MIBK	366.01
2-propoxyethanol	545.75
tert-butanol	248.25
MTBE	418.19
2-butoxyethanol	283.47
propionic acid	186.07
o-xylene	380.15
formic acid	21.62
diethyl ether	547.95
m-xylene	483.04
p-xylene	490.3
chlorobenzene	828.67
dimethyl carbonate	190.53
n-octane	43.51
formamide	61.3
cyclopentanone	1528.19
2-pentanone	703.79
anisole	469.68
cyclopentyl methyl ether	759.04
gamma-butyrolactone	1128.76
1-methoxy-2-propanol	280.07
pyridine	1581.13
3-pentanone	525.13
furfural	778.74
n-dodecane	36.97
diethylene glycol	205.94
diisopropyl ether	158.67
tert-amyl alcohol	218.16
acetylacetone	536.71
n-hexadecane	44.26
acetophenone	417.89
methyl propionate	442.69
isopentyl acetate	641.69
trichloroethylene	2233.0
n-nonanol	167.01
cyclohexanol	406.69
benzyl alcohol	394.22
2-ethylhexanol	291.0
isooctanol	166.6
dipropyl ether	366.97
1,2-dichlorobenzene	581.55
ethyl lactate	125.81
propylene carbonate	565.21
n-methylformamide	303.31
2-pentanol	218.51
n-pentane	69.25
1-propoxy-2-propanol	344.1
1-methoxy-2-propyl acetate	472.6
2-(2-methoxypropoxy) propanol	246.48
mesitylene	236.75
ε-caprolactone	962.79
p-cymene	229.24
epichlorohydrin	1475.1
1,1,1-trichloroethane	949.39
2-aminoethanol	75.29
morpholine-4-carbaldehyde	839.38
sulfolane	621.47
2,2,4-trimethylpentane	37.55
2-methyltetrahydrofuran	1179.78
n-hexyl acetate	497.21
isooctane	33.27
2-(2-butoxyethoxy)ethanol	330.24
sec-butyl acetate	293.8
tert-butyl acetate	334.81
decalin	85.5
glycerin	51.96
diglyme	632.45
acrylic acid	138.71
isopropyl myristate	208.8
n-butyric acid	359.97
acetyl acetate	283.34
di(2-ethylhexyl) phthalate	198.86
ethyl propionate	304.6
nitromethane	345.16
1,2-diethoxyethane	545.38
benzonitrile	597.61
trioctyl phosphate	138.38
1-bromopropane	816.35
gamma-valerolactone	1463.53
n-decanol	136.39
triethyl phosphate	146.63
4-methyl-2-pentanol	135.36
propionitrile	380.95
vinylene carbonate	547.75
1,1,2-trichlorotrifluoroethane	385.98
DMS	373.44
cumene	230.85
2-octanol	143.46
2-hexanone	471.35
octyl acetate	262.14
limonene	291.87
1,2-dimethoxyethane	689.17
ethyl orthosilicate	154.84
tributyl phosphate	162.46
diacetone alcohol	280.77
N,N-dimethylaniline	305.52
acrylonitrile	422.8
aniline	552.14
1,3-propanediol	162.27
bromobenzene	1016.32
dibromomethane	1495.16
1,1,2,2-tetrachloroethane	1337.8
2-methyl-cyclohexyl acetate	351.33
tetrabutyl urea	228.63
diisobutyl methanol	141.22
2-phenylethanol	472.47
styrene	439.92
dioctyl adipate	271.59
dimethyl sulfate	192.61
ethyl butyrate	384.88
methyl lactate	108.82
butyl lactate	213.79
diethyl carbonate	234.44
propanediol butyl ether	194.72
triethyl orthoformate	241.13
p-tert-butyltoluene	204.58
methyl 4-tert-butylbenzoate	299.41
morpholine	1321.85
tert-butylamine	187.21
n-dodecanol	115.12
dimethoxymethane	702.24
ethylene carbonate	479.65
cyrene	278.01
2-ethoxyethyl acetate	550.04
2-ethylhexyl acetate	537.32
1,2,4-trichlorobenzene	649.66
4-methylpyridine	1477.98
dibutyl ether	297.93
2,6-dimethyl-4-heptanol	141.22
DEF	624.71
dimethyl isosorbide	503.79
tetrachloroethylene	843.83
eugenol	280.88
triacetin	327.26
span 80	243.6
1,4-butanediol	83.96
1,1-dichloroethane	1067.46
2-methyl-1-pentanol	298.34
methyl formate	269.68
2-methyl-1-butanol	303.64
n-decane	56.8
butyronitrile	501.02
3,7-dimethyl-1-octanol	182.41
1-chlorooctane	211.3
1-chlorotetradecane	97.88
n-nonane	54.54
undecane	44.68
tert-butylcyclohexane	73.04
cyclooctane	62.62
cyclopentanol	377.75
tetrahydropyran	1427.9
tert-amyl methyl ether	281.97
2,5,8-trioxanonane	385.43
1-hexene	276.35
2-isopropoxyethanol	236.83
2,2,2-trifluoroethanol	47.06
methyl butyrate	447.78

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