Molecular formula
C21H36O

SMILES
CCC1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C

Fragrance
Woody	74.07%
Sweet	55.8%
Sandalwood	49.27%
Amber	46.32%
Balsamic	44.51%
Dry	42.74%
Musk	41.94%
Clean	40.0%
Cedar	35.08%
Animal	31.39%

 

Flavor
Sweet	42.5%
Earthy	34.33%
Woody	33.73%
Dry	27.8%
Herb	27.69%
Pine	27.05%
Camphor	26.49%
Wood	26.39%
Fir needle	26.3%
Herbal	26.26%

 

Odor impact est.
Low

XLogP3-AA
6.7

pKa est.
8.01 (weak base)

Molecular weight
304.5 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Very slow

Boiling point est.
403°C

Flash point

• 197.06 ˚C est.

• Pregnan-3-ol
• SCHEMBL878999

Pregnan-3-ol is a steroidal alcohol primarily used as an intermediate in the synthesis of steroid compounds and related pharmaceutical products; it also serves as a building block for steroid derivatives in drug development and may be considered for cosmetic and personal care applications through the synthesis of steroid-derived ingredients used in skin-care formulations or fragrance components, subject to safety constraints and local regulations.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	410.91
methanol	171.44
isopropanol	469.83
water	0.73
ethyl acetate	556.64
n-propanol	505.29
acetone	805.44
n-butanol	574.5
acetonitrile	283.68
DMF	534.98
toluene	621.94
isobutanol	299.98
1,4-dioxane	1195.49
methyl acetate	278.65
THF	2327.8
2-butanone	486.09
n-pentanol	101.51
sec-butanol	136.94
n-hexane	20.03
ethylene glycol	12.76
NMP	114.53
cyclohexane	109.63
DMSO	159.99
n-butyl acetate	362.32
n-octanol	56.28
chloroform	705.2
n-propyl acetate	185.0
acetic acid	78.48
dichloromethane	539.65
cyclohexanone	598.77
propylene glycol	20.26
isopropyl acetate	520.61
DMAc	211.72
2-ethoxyethanol	166.72
isopentanol	392.02
n-heptane	30.99
ethyl formate	156.46
1,2-dichloroethane	451.18
n-hexanol	215.46
2-methoxyethanol	496.8
isobutyl acetate	169.97
tetrachloromethane	140.11
n-pentyl acetate	187.86
transcutol	887.19
n-heptanol	95.02
ethylbenzene	115.32
MIBK	429.84
2-propoxyethanol	448.33
tert-butanol	379.84
MTBE	604.83
2-butoxyethanol	222.09
propionic acid	87.16
o-xylene	199.45
formic acid	18.81
diethyl ether	1144.97
m-xylene	347.23
p-xylene	132.5
chlorobenzene	303.93
dimethyl carbonate	126.19
n-octane	9.48
formamide	52.33
cyclopentanone	688.84
2-pentanone	664.03
anisole	232.93
cyclopentyl methyl ether	657.09
gamma-butyrolactone	464.1
1-methoxy-2-propanol	435.08
pyridine	668.7
3-pentanone	346.25
furfural	273.32
n-dodecane	5.51
diethylene glycol	162.29
diisopropyl ether	266.25
tert-amyl alcohol	102.73
acetylacetone	543.81
n-hexadecane	6.97
acetophenone	145.27
methyl propionate	310.33
isopentyl acetate	366.76
trichloroethylene	548.55
n-nonanol	60.69
cyclohexanol	230.42
benzyl alcohol	111.99
2-ethylhexanol	108.89
isooctanol	82.64
dipropyl ether	348.86
1,2-dichlorobenzene	211.55
ethyl lactate	59.96
propylene carbonate	195.01
n-methylformamide	185.8
2-pentanol	228.85
n-pentane	57.58
1-propoxy-2-propanol	319.1
1-methoxy-2-propyl acetate	449.63
2-(2-methoxypropoxy) propanol	150.3
mesitylene	199.23
ε-caprolactone	362.16
p-cymene	86.42
epichlorohydrin	650.17
1,1,1-trichloroethane	368.98
2-aminoethanol	54.32
morpholine-4-carbaldehyde	302.46
sulfolane	222.19
2,2,4-trimethylpentane	17.11
2-methyltetrahydrofuran	738.08
n-hexyl acetate	186.25
isooctane	27.11
2-(2-butoxyethoxy)ethanol	248.81
sec-butyl acetate	159.3
tert-butyl acetate	474.87
decalin	22.24
glycerin	35.8
diglyme	566.75
acrylic acid	52.39
isopropyl myristate	79.86
n-butyric acid	295.19
acetyl acetate	249.16
di(2-ethylhexyl) phthalate	63.42
ethyl propionate	188.49
nitromethane	202.64
1,2-diethoxyethane	471.11
benzonitrile	192.93
trioctyl phosphate	48.8
1-bromopropane	372.6
gamma-valerolactone	770.41
n-decanol	44.23
triethyl phosphate	87.29
4-methyl-2-pentanol	167.08
propionitrile	416.32
vinylene carbonate	196.55
1,1,2-trichlorotrifluoroethane	146.58
DMS	148.65
cumene	72.38
2-octanol	49.24
2-hexanone	150.46
octyl acetate	83.92
limonene	101.81
1,2-dimethoxyethane	533.27
ethyl orthosilicate	99.84
tributyl phosphate	58.06
diacetone alcohol	242.36
N,N-dimethylaniline	116.62
acrylonitrile	289.38
aniline	366.18
1,3-propanediol	232.53
bromobenzene	354.45
dibromomethane	404.65
1,1,2,2-tetrachloroethane	380.66
2-methyl-cyclohexyl acetate	139.27
tetrabutyl urea	69.56
diisobutyl methanol	100.0
2-phenylethanol	180.08
styrene	144.17
dioctyl adipate	92.39
dimethyl sulfate	106.87
ethyl butyrate	242.65
methyl lactate	80.55
butyl lactate	117.41
diethyl carbonate	136.01
propanediol butyl ether	101.8
triethyl orthoformate	188.69
p-tert-butyltoluene	93.89
methyl 4-tert-butylbenzoate	160.36
morpholine	1134.92
tert-butylamine	292.31
n-dodecanol	32.67
dimethoxymethane	983.23
ethylene carbonate	218.14
cyrene	91.7
2-ethoxyethyl acetate	301.23
2-ethylhexyl acetate	247.17
1,2,4-trichlorobenzene	207.09
4-methylpyridine	585.32
dibutyl ether	147.96
2,6-dimethyl-4-heptanol	100.0
DEF	309.06
dimethyl isosorbide	271.6
tetrachloroethylene	273.27
eugenol	131.09
triacetin	168.09
span 80	104.97
1,4-butanediol	28.17
1,1-dichloroethane	452.54
2-methyl-1-pentanol	81.67
methyl formate	110.97
2-methyl-1-butanol	212.73
n-decane	11.95
butyronitrile	519.35
3,7-dimethyl-1-octanol	82.82
1-chlorooctane	48.66
1-chlorotetradecane	17.54
n-nonane	10.56
undecane	7.66
tert-butylcyclohexane	19.46
cyclooctane	37.0
cyclopentanol	199.67
tetrahydropyran	1468.68
tert-amyl methyl ether	197.14
2,5,8-trioxanonane	276.64
1-hexene	70.25
2-isopropoxyethanol	126.89
2,2,2-trifluoroethanol	36.59
methyl butyrate	192.25

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