Molecular formula
C19H18O2

SMILES
CC1=CC=C(C=C1)O.C1=CC=C(C=C1)OC2=CC=CC=C2

Fragrance
Phenolic	86.91%
Medicinal	64.46%
Smoky	52.44%
Animal	52.32%
Leathery	49.45%
Woody	39.2%
Burnt	34.62%
Musty	33.8%
Spicy	30.86%
Nutty	27.55%

 

Flavor
Phenolic	85.29%
Medicinal	69.67%
Phenol	56.9%
Smoke	47.54%
Plastic	42.12%
Medical	36.76%
Naphthyl	35.69%
Medicine	34.56%
Leather	32.59%
Smoky	31.75%

 

Odor impact est.
High

pKa est.
9.85 (weak base)

Molecular weight
278.3 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Moderate

Boiling point est.
199°C

Flash point

• 83.95 ˚C est.

4-Methylphenol;phenoxybenzene is used as an intermediate in the synthesis of dyes, pigments, and specialty chemicals, and as a processing solvent or solubilizer in industrial formulations. In the polymers and coatings industries it serves as a precursor for resin and additive components. In perfumery and personal care, it may be employed as an odorant or fragrance note in limited formulations. In cleaning and industrial maintenance products, it can function as a solvent or reactive intermediate under appropriate safety and regulatory restrictions.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	1217.82
methanol	909.41
isopropanol	1015.81
water	6.34
ethyl acetate	827.18
n-propanol	957.52
acetone	1068.78
n-butanol	738.78
acetonitrile	679.33
DMF	955.83
toluene	102.79
isobutanol	601.22
1,4-dioxane	811.03
methyl acetate	888.12
THF	1262.42
2-butanone	977.96
n-pentanol	485.06
sec-butanol	757.11
n-hexane	39.12
ethylene glycol	277.48
NMP	272.09
cyclohexane	16.7
DMSO	697.5
n-butyl acetate	337.04
n-octanol	249.77
chloroform	467.74
n-propyl acetate	358.6
acetic acid	382.45
dichloromethane	342.77
cyclohexanone	383.83
propylene glycol	477.82
isopropyl acetate	347.81
DMAc	667.28
2-ethoxyethanol	643.11
isopentanol	469.97
n-heptane	36.21
ethyl formate	444.33
1,2-dichloroethane	284.16
n-hexanol	638.18
2-methoxyethanol	1091.61
isobutyl acetate	209.61
tetrachloromethane	90.77
n-pentyl acetate	179.37
transcutol	871.07
n-heptanol	267.45
ethylbenzene	94.27
MIBK	295.33
2-propoxyethanol	901.33
tert-butanol	810.78
MTBE	524.61
2-butoxyethanol	436.52
propionic acid	549.77
o-xylene	68.64
formic acid	171.5
diethyl ether	518.62
m-xylene	85.82
p-xylene	97.37
chlorobenzene	126.72
dimethyl carbonate	237.3
n-octane	19.48
formamide	312.49
cyclopentanone	660.69
2-pentanone	611.58
anisole	279.25
cyclopentyl methyl ether	351.9
gamma-butyrolactone	603.37
1-methoxy-2-propanol	971.95
pyridine	358.48
3-pentanone	359.46
furfural	399.39
n-dodecane	18.39
diethylene glycol	591.03
diisopropyl ether	109.01
tert-amyl alcohol	621.23
acetylacetone	454.58
n-hexadecane	19.59
acetophenone	170.73
methyl propionate	613.65
isopentyl acetate	239.34
trichloroethylene	446.38
n-nonanol	203.89
cyclohexanol	232.38
benzyl alcohol	199.13
2-ethylhexanol	245.99
isooctanol	185.73
dipropyl ether	253.73
1,2-dichlorobenzene	99.18
ethyl lactate	189.32
propylene carbonate	270.67
n-methylformamide	673.89
2-pentanol	438.31
n-pentane	29.62
1-propoxy-2-propanol	549.73
1-methoxy-2-propyl acetate	341.76
2-(2-methoxypropoxy) propanol	262.23
mesitylene	50.12
ε-caprolactone	341.56
p-cymene	57.91
epichlorohydrin	729.68
1,1,1-trichloroethane	305.52
2-aminoethanol	589.75
morpholine-4-carbaldehyde	511.09
sulfolane	385.39
2,2,4-trimethylpentane	20.43
2-methyltetrahydrofuran	691.3
n-hexyl acetate	265.36
isooctane	21.73
2-(2-butoxyethoxy)ethanol	407.09
sec-butyl acetate	205.66
tert-butyl acetate	288.27
decalin	19.75
glycerin	436.33
diglyme	633.76
acrylic acid	340.94
isopropyl myristate	92.62
n-butyric acid	613.47
acetyl acetate	253.54
di(2-ethylhexyl) phthalate	78.37
ethyl propionate	332.63
nitromethane	772.25
1,2-diethoxyethane	319.36
benzonitrile	179.46
trioctyl phosphate	74.68
1-bromopropane	225.07
gamma-valerolactone	684.8
n-decanol	157.64
triethyl phosphate	78.63
4-methyl-2-pentanol	229.69
propionitrile	613.5
vinylene carbonate	249.95
1,1,2-trichlorotrifluoroethane	389.17
DMS	174.24
cumene	68.76
2-octanol	172.19
2-hexanone	375.08
octyl acetate	139.11
limonene	76.63
1,2-dimethoxyethane	771.47
ethyl orthosilicate	78.74
tributyl phosphate	74.55
diacetone alcohol	434.69
N,N-dimethylaniline	148.78
acrylonitrile	617.4
aniline	188.02
1,3-propanediol	709.21
bromobenzene	106.51
dibromomethane	236.6
1,1,2,2-tetrachloroethane	357.34
2-methyl-cyclohexyl acetate	122.82
tetrabutyl urea	97.58
diisobutyl methanol	124.44
2-phenylethanol	264.13
styrene	101.54
dioctyl adipate	102.54
dimethyl sulfate	248.58
ethyl butyrate	217.72
methyl lactate	305.57
butyl lactate	152.81
diethyl carbonate	129.95
propanediol butyl ether	345.42
triethyl orthoformate	115.43
p-tert-butyltoluene	60.43
methyl 4-tert-butylbenzoate	171.47
morpholine	899.2
tert-butylamine	387.49
n-dodecanol	116.0
dimethoxymethane	701.99
ethylene carbonate	220.14
cyrene	177.83
2-ethoxyethyl acetate	260.69
2-ethylhexyl acetate	158.62
1,2,4-trichlorobenzene	113.06
4-methylpyridine	332.59
dibutyl ether	180.43
2,6-dimethyl-4-heptanol	124.44
DEF	421.48
dimethyl isosorbide	314.87
tetrachloroethylene	195.28
eugenol	212.68
triacetin	171.9
span 80	225.93
1,4-butanediol	292.21
1,1-dichloroethane	426.01
2-methyl-1-pentanol	326.15
methyl formate	459.11
2-methyl-1-butanol	449.96
n-decane	30.43
butyronitrile	535.4
3,7-dimethyl-1-octanol	199.63
1-chlorooctane	113.66
1-chlorotetradecane	42.42
n-nonane	30.31
undecane	23.01
tert-butylcyclohexane	30.38
cyclooctane	9.28
cyclopentanol	357.63
tetrahydropyran	599.47
tert-amyl methyl ether	310.58
2,5,8-trioxanonane	401.25
1-hexene	186.57
2-isopropoxyethanol	463.24
2,2,2-trifluoroethanol	165.71
methyl butyrate	389.11

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