Công thức phân tử
C17H19NOS

SMILES
CC1=CC(=C(C=C1)C)NC(=O)C(C)SC2=CC=CC=C2

Hương thơm
Trái cây	79.5%
Thịt	49.63%
Béo	46.77%
Nho	39.07%
Nhiệt đới	38.84%
Rang cháy	37.17%
Bưởi	35.18%
Cam chanh	34.16%
Nấu chín	32.79%
Thơm ngon	31.98%

 

Hương vị
Bitter	36.9%
Mild	26.47%
Odorless	25.25%
Roasted	23.75%
Scallion	20.76%
Nitrile	20.7%
Orange flower	19.98%
Turnup	19.85%
Meaty	19.63%
Very strong	19.58%

 

Cường độ mùi ước lượng
Thấp

XLogP3-AA
4.1

pKa ước lượng
6.92 (trung tính)

Khối lượng phân tử
285.4 g/mol

Áp suất hơi ước lượng

• hPa @ 20°C
• hPa @ 25°C

Tốc độ bay hơi
Cực chậm

Điểm sôi ước lượng
428°C

Điểm chớp cháy

• 188.75 ˚C ước lượng

• N-(2,5-dimethylphenyl)-2-phenylsulfanylpropanamide
• N-(2,5-dimethylphenyl)-2-(phenylsulfanyl)propanamide
• Cambridge id 6221983
• Oprea1_077375
• Oprea1_456605
• AKOS008456426
• AG-690/15438865

N-(2,5-dimethylphenyl)-2-phenylsulfanylpropanamide thường được xem như một trung gian tổng hợp trong phát triển dược phẩm và hóa chất nông nghiệp; nó cũng đóng vai trò là khung nền cho các phản ứng tổng hợp hữu cơ và làm tiền thân cho các biến đổi trên vòng thơm. Trong lĩnh vực nghiên cứu và phát triển, nó được sử dụng làm cơ sở cho các dự án SAR (structure–activity relationship) trong dược phẩm, và có thể là tiền thân cho tổng hợp polyme đặc biệt và lớp phủ.

gpt-5-nano

Dung môi	Độ tan (g/L)
ethanol	89.59
methanol	85.71
isopropanol	51.91
water	0.17
ethyl acetate	246.01
n-propanol	76.37
acetone	351.39
n-butanol	64.57
acetonitrile	124.96
DMF	866.41
toluene	74.08
isobutanol	44.84
1,4-dioxane	471.19
methyl acetate	274.13
THF	582.09
2-butanone	343.08
n-pentanol	65.05
sec-butanol	51.12
n-hexane	0.88
ethylene glycol	12.01
NMP	328.59
cyclohexane	2.3
DMSO	305.25
n-butyl acetate	139.67
n-octanol	34.91
chloroform	622.17
n-propyl acetate	145.56
acetic acid	127.01
dichloromethane	579.14
cyclohexanone	376.81
propylene glycol	33.15
isopropyl acetate	112.33
DMAc	872.33
2-ethoxyethanol	159.81
isopentanol	57.15
n-heptane	1.89
ethyl formate	156.31
1,2-dichloroethane	394.41
n-hexanol	65.48
2-methoxyethanol	203.13
isobutyl acetate	92.1
tetrachloromethane	18.63
n-pentyl acetate	81.33
transcutol	393.5
n-heptanol	43.73
ethylbenzene	41.71
MIBK	104.55
2-propoxyethanol	170.59
tert-butanol	59.79
MTBE	78.95
2-butoxyethanol	110.69
propionic acid	97.52
o-xylene	38.89
formic acid	34.9
diethyl ether	97.72
m-xylene	40.37
p-xylene	54.7
chlorobenzene	149.88
dimethyl carbonate	114.14
n-octane	1.5
formamide	97.45
cyclopentanone	547.46
2-pentanone	202.62
anisole	140.63
cyclopentyl methyl ether	126.22
gamma-butyrolactone	487.22
1-methoxy-2-propanol	150.97
pyridine	327.52
3-pentanone	172.18
furfural	370.3
n-dodecane	1.86
diethylene glycol	108.37
diisopropyl ether	18.55
tert-amyl alcohol	53.44
acetylacetone	257.36
n-hexadecane	2.21
acetophenone	143.27
methyl propionate	211.1
isopentyl acetate	116.79
trichloroethylene	782.0
n-nonanol	35.35
cyclohexanol	53.45
benzyl alcohol	109.82
2-ethylhexanol	43.45
isooctanol	37.37
dipropyl ether	48.47
1,2-dichlorobenzene	131.32
ethyl lactate	65.69
propylene carbonate	230.19
n-methylformamide	219.82
2-pentanol	36.14
n-pentane	0.65
1-propoxy-2-propanol	115.84
1-methoxy-2-propyl acetate	151.29
2-(2-methoxypropoxy) propanol	94.52
mesitylene	19.59
ε-caprolactone	264.85
p-cymene	25.42
epichlorohydrin	644.01
1,1,1-trichloroethane	174.85
2-aminoethanol	42.24
morpholine-4-carbaldehyde	408.76
sulfolane	381.36
2,2,4-trimethylpentane	1.76
2-methyltetrahydrofuran	229.55
n-hexyl acetate	96.7
isooctane	1.35
2-(2-butoxyethoxy)ethanol	136.63
sec-butyl acetate	90.05
tert-butyl acetate	104.44
decalin	3.39
glycerin	49.43
diglyme	290.84
acrylic acid	89.74
isopropyl myristate	36.45
n-butyric acid	134.4
acetyl acetate	130.13
di(2-ethylhexyl) phthalate	45.52
ethyl propionate	114.64
nitromethane	396.27
1,2-diethoxyethane	149.19
benzonitrile	135.11
trioctyl phosphate	28.67
1-bromopropane	101.52
gamma-valerolactone	610.21
n-decanol	26.03
triethyl phosphate	50.57
4-methyl-2-pentanol	28.72
propionitrile	110.28
vinylene carbonate	225.11
1,1,2-trichlorotrifluoroethane	250.65
DMS	110.76
cumene	26.51
2-octanol	28.94
2-hexanone	144.57
octyl acetate	49.32
limonene	32.36
1,2-dimethoxyethane	296.95
ethyl orthosilicate	46.85
tributyl phosphate	36.27
diacetone alcohol	117.54
N,N-dimethylaniline	75.35
acrylonitrile	161.74
aniline	99.12
1,3-propanediol	71.56
bromobenzene	139.64
dibromomethane	275.43
1,1,2,2-tetrachloroethane	515.39
2-methyl-cyclohexyl acetate	81.08
tetrabutyl urea	51.99
diisobutyl methanol	24.36
2-phenylethanol	97.56
styrene	57.31
dioctyl adipate	63.01
dimethyl sulfate	164.61
ethyl butyrate	100.71
methyl lactate	86.53
butyl lactate	69.69
diethyl carbonate	70.29
propanediol butyl ether	87.62
triethyl orthoformate	66.86
p-tert-butyltoluene	22.93
methyl 4-tert-butylbenzoate	97.52
morpholine	441.88
tert-butylamine	25.35
n-dodecanol	19.48
dimethoxymethane	325.86
ethylene carbonate	177.53
cyrene	127.9
2-ethoxyethyl acetate	149.72
2-ethylhexyl acetate	91.6
1,2,4-trichlorobenzene	154.63
4-methylpyridine	291.23
dibutyl ether	46.4
2,6-dimethyl-4-heptanol	24.36
DEF	238.03
dimethyl isosorbide	188.28
tetrachloroethylene	238.92
eugenol	106.08
triacetin	111.82
span 80	78.62
1,4-butanediol	37.77
1,1-dichloroethane	273.01
2-methyl-1-pentanol	64.75
methyl formate	191.85
2-methyl-1-butanol	51.28
n-decane	3.04
butyronitrile	111.77
3,7-dimethyl-1-octanol	34.87
1-chlorooctane	21.43
1-chlorotetradecane	8.81
n-nonane	2.41
undecane	2.29
tert-butylcyclohexane	3.38
cyclooctane	0.82
cyclopentanol	65.63
tetrahydropyran	275.63
tert-amyl methyl ether	58.35
2,5,8-trioxanonane	178.52
1-hexene	13.47
2-isopropoxyethanol	112.14
2,2,2-trifluoroethanol	51.81
methyl butyrate	159.87

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