Molecular formula
C14H28O

SMILES
CCCCCCCCCCCC(C)C=O

Fragrance
Fatty	71.01%
Waxy	69.55%
Citrus	67.52%
Fruity	48.63%
Fresh	48.13%
Orange	47.64%
Aldehydic	47.59%
Meaty	38.3%
Fruit skin	37.91%
Green	37.18%

 

Flavor
Waxy	68.19%
Citrus	52.58%
Fresh	49.81%
Aldehydic	45.36%
Floral	44.81%
Fatty	40.64%
Fat	40.03%
Soapy	38.92%
Orange	34.3%
Flower	32.86%

 

Odor impact est.
High

XLogP3-AA
6.0

pKa est.
7.32 (neutral)

Molecular weight
212.37 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Very slow

Boiling point est.
274°C

Flash point

• 117.33 ˚C est.

• 2-methyltridecanal
• SCHEMBL2038679
• AKOS013991765

2-Methyltridecanal is a long-chain aliphatic aldehyde commonly used as a fragrance ingredient and odorant in perfumery, contributing woody-to-floral notes and acting as a fixative in formulated scents. It is also employed in cosmetics and personal care products as a fragrance component to impart lasting aroma. In household products, it can serve as an odor-active additive in air fresheners, detergents, and cleaners. In the flavor and fragrance sector, it may be used as a flavor/aroma ingredient or as an intermediate for the synthesis of more complex fragrance molecules. In industrial manufacturing, it is often used as an intermediate in organic synthesis for fragrance-related compounds, subject to formulation requirements and local regulations.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	2430.93
methanol	1322.8
isopropanol	3469.77
water	0.01
ethyl acetate	6119.79
n-propanol	2845.32
acetone	5948.98
n-butanol	3099.68
acetonitrile	2391.87
DMF	2927.22
toluene	1732.08
isobutanol	2461.32
1,4-dioxane	4408.98
methyl acetate	3035.11
THF	8547.19
2-butanone	5623.44
n-pentanol	2040.77
sec-butanol	3114.71
n-hexane	2486.2
ethylene glycol	62.3
NMP	2407.1
cyclohexane	3510.3
DMSO	2951.98
n-butyl acetate	6835.88
n-octanol	1016.27
chloroform	7197.99
n-propyl acetate	5226.22
acetic acid	1022.07
dichloromethane	7306.57
cyclohexanone	8193.45
propylene glycol	252.92
isopropyl acetate	4281.59
DMAc	2126.33
2-ethoxyethanol	2012.57
isopentanol	3274.58
n-heptane	1506.77
ethyl formate	2221.02
1,2-dichloroethane	6246.54
n-hexanol	2553.16
2-methoxyethanol	2563.44
isobutyl acetate	2852.67
tetrachloromethane	1878.65
n-pentyl acetate	3467.54
transcutol	6830.29
n-heptanol	1093.77
ethylbenzene	1186.58
MIBK	3474.47
2-propoxyethanol	2910.39
tert-butanol	4573.74
MTBE	6510.77
2-butoxyethanol	1893.31
propionic acid	1470.62
o-xylene	1131.09
formic acid	102.88
diethyl ether	7469.24
m-xylene	1232.04
p-xylene	1531.78
chlorobenzene	2510.36
dimethyl carbonate	484.11
n-octane	426.08
formamide	242.83
cyclopentanone	6065.73
2-pentanone	6370.72
anisole	1839.04
cyclopentyl methyl ether	5744.67
gamma-butyrolactone	4874.26
1-methoxy-2-propanol	2926.09
pyridine	4208.05
3-pentanone	3625.28
furfural	3136.28
n-dodecane	153.44
diethylene glycol	781.39
diisopropyl ether	2412.44
tert-amyl alcohol	3557.39
acetylacetone	3841.79
n-hexadecane	191.66
acetophenone	1649.95
methyl propionate	2962.74
isopentyl acetate	5612.88
trichloroethylene	7890.22
n-nonanol	911.49
cyclohexanol	3841.68
benzyl alcohol	1095.15
2-ethylhexanol	2387.59
isooctanol	1184.17
dipropyl ether	5914.06
1,2-dichlorobenzene	2351.25
ethyl lactate	955.94
propylene carbonate	2896.19
n-methylformamide	1216.85
2-pentanol	2846.87
n-pentane	1323.72
1-propoxy-2-propanol	3672.65
1-methoxy-2-propyl acetate	3539.34
2-(2-methoxypropoxy) propanol	1176.62
mesitylene	932.48
ε-caprolactone	5669.36
p-cymene	937.42
epichlorohydrin	5831.23
1,1,1-trichloroethane	6752.62
2-aminoethanol	348.23
morpholine-4-carbaldehyde	2676.93
sulfolane	4630.31
2,2,4-trimethylpentane	458.61
2-methyltetrahydrofuran	7655.96
n-hexyl acetate	3236.61
isooctane	435.02
2-(2-butoxyethoxy)ethanol	1829.12
sec-butyl acetate	3668.31
tert-butyl acetate	4305.27
decalin	827.72
glycerin	265.84
diglyme	4083.64
acrylic acid	686.47
isopropyl myristate	1117.99
n-butyric acid	4243.28
acetyl acetate	2203.17
di(2-ethylhexyl) phthalate	570.69
ethyl propionate	4014.94
nitromethane	2282.83
1,2-diethoxyethane	5436.09
benzonitrile	2028.53
trioctyl phosphate	521.36
1-bromopropane	6112.62
gamma-valerolactone	6166.8
n-decanol	605.14
triethyl phosphate	1133.59
4-methyl-2-pentanol	1629.46
propionitrile	3181.83
vinylene carbonate	1969.74
1,1,2-trichlorotrifluoroethane	2516.2
DMS	1307.79
cumene	790.88
2-octanol	1017.13
2-hexanone	4539.75
octyl acetate	1161.99
limonene	1915.12
1,2-dimethoxyethane	5577.58
ethyl orthosilicate	1265.89
tributyl phosphate	767.39
diacetone alcohol	2936.74
N,N-dimethylaniline	1075.29
acrylonitrile	2236.21
aniline	1675.95
1,3-propanediol	967.36
bromobenzene	2964.62
dibromomethane	6017.61
1,1,2,2-tetrachloroethane	7066.76
2-methyl-cyclohexyl acetate	2194.55
tetrabutyl urea	941.53
diisobutyl methanol	1551.98
2-phenylethanol	1268.12
styrene	1517.7
dioctyl adipate	1303.07
dimethyl sulfate	747.1
ethyl butyrate	5032.74
methyl lactate	676.48
butyl lactate	1661.21
diethyl carbonate	2206.41
propanediol butyl ether	1075.17
triethyl orthoformate	2834.8
p-tert-butyltoluene	885.64
methyl 4-tert-butylbenzoate	1260.11
morpholine	6354.41
tert-butylamine	3613.97
n-dodecanol	450.01
dimethoxymethane	2449.77
ethylene carbonate	2207.85
cyrene	830.88
2-ethoxyethyl acetate	2926.78
2-ethylhexyl acetate	4338.91
1,2,4-trichlorobenzene	2353.94
4-methylpyridine	4371.0
dibutyl ether	4099.43
2,6-dimethyl-4-heptanol	1551.98
DEF	4985.94
dimethyl isosorbide	2252.12
tetrachloroethylene	4472.11
eugenol	1011.69
triacetin	1724.83
span 80	1188.38
1,4-butanediol	341.19
1,1-dichloroethane	7107.68
2-methyl-1-pentanol	2020.79
methyl formate	725.52
2-methyl-1-butanol	2622.18
n-decane	390.86
butyronitrile	4581.15
3,7-dimethyl-1-octanol	1382.21
1-chlorooctane	1420.14
1-chlorotetradecane	403.16
n-nonane	463.53
undecane	226.08
tert-butylcyclohexane	735.76
cyclooctane	887.91
cyclopentanol	2994.18
tetrahydropyran	9824.14
tert-amyl methyl ether	3839.16
2,5,8-trioxanonane	1952.53
1-hexene	5069.77
2-isopropoxyethanol	1877.93
2,2,2-trifluoroethanol	265.67
methyl butyrate	5604.13

Scent© AI