Molecular formula
C12H16O3

SMILES
COCC1COC(O1)CC2=CC=CC=C2

Fragrance
Green	75.99%
Floral	72.66%
Sweet	64.1%
Rose	62.7%
Hyacinth	52.98%
Honey	50.04%
Fruity	43.28%
Fresh	42.94%
Earthy	39.49%
Leafy	34.75%

 

Flavor
Green	56.73%
Bitter	54.84%
Floral	53.39%
Sweet	47.73%
Earthy	38.06%
Hyacinth	29.29%
Mushroom	28.23%
Rose	27.63%
Metallic	27.54%
Oily	26.26%

 

Odor impact est.
Medium

XLogP3-AA
1.7

pKa est.
5.61 (weak acid)

Molecular weight
208.25 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Ultra slow

Boiling point est.
312°C

Flash point

• 118.19 ˚C est.

• NSC23493
• NSC-23493

2-Benzyl-4-(methoxymethyl)-1,3-dioxolane is primarily used as an organic synthesis intermediate. In practice it serves as a protected carbonyl/diol building block suitable for carbohydrate and fine chemical synthesis, acting as a protected substrate in controlled transformations. It is commonly evaluated for pharmaceutical and agrochemical intermediate applications, enabling routes to more complex molecules. In fragrance and cosmetics chemistry, it can act as a precursor for aroma compounds or as a protected scaffolding during formulation work. Overall, its role is as a versatile building block and protecting group in modern chemical manufacturing, subject to local regulations and formulation limits.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	737.97
methanol	831.72
isopropanol	369.23
water	6.87
ethyl acetate	504.55
n-propanol	445.44
acetone	283.6
n-butanol	352.47
acetonitrile	488.55
DMF	227.73
toluene	168.8
isobutanol	232.27
1,4-dioxane	1114.94
methyl acetate	360.79
THF	536.92
2-butanone	250.5
n-pentanol	226.39
sec-butanol	257.78
n-hexane	9.17
ethylene glycol	359.25
NMP	131.27
cyclohexane	45.68
DMSO	800.75
n-butyl acetate	133.04
n-octanol	60.86
chloroform	1927.19
n-propyl acetate	176.78
acetic acid	859.84
dichloromethane	1623.66
cyclohexanone	280.26
propylene glycol	428.76
isopropyl acetate	171.55
DMAc	298.76
2-ethoxyethanol	619.05
isopentanol	206.21
n-heptane	13.69
ethyl formate	262.44
1,2-dichloroethane	750.32
n-hexanol	163.2
2-methoxyethanol	914.97
isobutyl acetate	106.47
tetrachloromethane	130.49
n-pentyl acetate	62.26
transcutol	1155.36
n-heptanol	60.77
ethylbenzene	64.15
MIBK	108.45
2-propoxyethanol	400.9
tert-butanol	337.36
MTBE	164.87
2-butoxyethanol	166.32
propionic acid	368.99
o-xylene	92.74
formic acid	406.87
diethyl ether	339.38
m-xylene	97.61
p-xylene	83.78
chlorobenzene	227.23
dimethyl carbonate	132.4
n-octane	5.75
formamide	420.66
cyclopentanone	234.9
2-pentanone	173.39
anisole	190.64
cyclopentyl methyl ether	218.86
gamma-butyrolactone	349.95
1-methoxy-2-propanol	546.91
pyridine	576.71
3-pentanone	155.65
furfural	426.02
n-dodecane	7.16
diethylene glycol	506.46
diisopropyl ether	53.48
tert-amyl alcohol	185.01
acetylacetone	248.82
n-hexadecane	8.1
acetophenone	165.7
methyl propionate	279.85
isopentyl acetate	117.24
trichloroethylene	1168.59
n-nonanol	59.6
cyclohexanol	277.09
benzyl alcohol	208.86
2-ethylhexanol	81.62
isooctanol	49.29
dipropyl ether	113.88
1,2-dichlorobenzene	197.26
ethyl lactate	129.91
propylene carbonate	241.63
n-methylformamide	224.24
2-pentanol	168.42
n-pentane	12.84
1-propoxy-2-propanol	218.68
1-methoxy-2-propyl acetate	192.45
2-(2-methoxypropoxy) propanol	188.22
mesitylene	59.34
ε-caprolactone	289.38
p-cymene	45.79
epichlorohydrin	661.38
1,1,1-trichloroethane	493.47
2-aminoethanol	479.41
morpholine-4-carbaldehyde	373.35
sulfolane	300.68
2,2,4-trimethylpentane	10.7
2-methyltetrahydrofuran	343.53
n-hexyl acetate	96.22
isooctane	7.83
2-(2-butoxyethoxy)ethanol	269.98
sec-butyl acetate	108.54
tert-butyl acetate	136.15
decalin	19.25
glycerin	507.93
diglyme	516.19
acrylic acid	351.4
isopropyl myristate	50.09
n-butyric acid	450.15
acetyl acetate	290.39
di(2-ethylhexyl) phthalate	61.28
ethyl propionate	155.35
nitromethane	780.07
1,2-diethoxyethane	247.69
benzonitrile	202.5
trioctyl phosphate	36.5
1-bromopropane	313.19
gamma-valerolactone	386.79
n-decanol	46.89
triethyl phosphate	77.99
4-methyl-2-pentanol	77.41
propionitrile	277.88
vinylene carbonate	276.9
1,1,2-trichlorotrifluoroethane	591.27
DMS	126.46
cumene	45.8
2-octanol	32.51
2-hexanone	118.55
octyl acetate	59.86
limonene	61.28
1,2-dimethoxyethane	558.44
ethyl orthosilicate	74.76
tributyl phosphate	50.21
diacetone alcohol	171.58
N,N-dimethylaniline	108.38
acrylonitrile	331.01
aniline	283.41
1,3-propanediol	622.63
bromobenzene	234.87
dibromomethane	911.16
1,1,2,2-tetrachloroethane	964.28
2-methyl-cyclohexyl acetate	103.42
tetrabutyl urea	61.04
diisobutyl methanol	49.17
2-phenylethanol	148.9
styrene	94.38
dioctyl adipate	88.97
dimethyl sulfate	159.35
ethyl butyrate	127.53
methyl lactate	184.5
butyl lactate	78.93
diethyl carbonate	111.31
propanediol butyl ether	163.94
triethyl orthoformate	105.38
p-tert-butyltoluene	43.5
methyl 4-tert-butylbenzoate	119.13
morpholine	1063.75
tert-butylamine	162.18
n-dodecanol	40.46
dimethoxymethane	356.95
ethylene carbonate	245.92
cyrene	153.11
2-ethoxyethyl acetate	133.52
2-ethylhexyl acetate	87.65
1,2,4-trichlorobenzene	236.26
4-methylpyridine	316.76
dibutyl ether	78.13
2,6-dimethyl-4-heptanol	49.17
DEF	218.31
dimethyl isosorbide	227.62
tetrachloroethylene	594.89
eugenol	129.88
triacetin	157.27
span 80	130.6
1,4-butanediol	251.51
1,1-dichloroethane	667.91
2-methyl-1-pentanol	144.43
methyl formate	187.21
2-methyl-1-butanol	176.41
n-decane	10.37
butyronitrile	255.32
3,7-dimethyl-1-octanol	66.72
1-chlorooctane	43.53
1-chlorotetradecane	22.28
n-nonane	9.12
undecane	8.22
tert-butylcyclohexane	14.21
cyclooctane	14.5
cyclopentanol	207.21
tetrahydropyran	636.43
tert-amyl methyl ether	114.39
2,5,8-trioxanonane	375.73
1-hexene	47.33
2-isopropoxyethanol	312.45
2,2,2-trifluoroethanol	302.76
methyl butyrate	187.04

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