Molecular formula
C6H14Cl2N2O4S2

SMILES
C([C@@H](C(=O)O)N)SSCC(C(=O)O)N.Cl.Cl

Fragrance
Odorless	53.66%
Meaty	49.01%
Savory	47.13%
Sulfurous	46.97%
Cooked	31.55%
Roasted	30.05%
Onion	24.01%
Garlic	20.54%
Beefy	20.52%
Sweet	19.71%

 

Flavor
Odorless	51.44%
Bitter	34.59%
Bland	31.82%
Mild	31.41%
Sulfury	27.57%
Cooked	25.71%
Roasted	25.01%
Sulfurous	23.05%
Sweet-like	22.91%
Yeast	21.95%

 

Odor impact est.
Low

pKa est.
5.05 (weak acid)

Molecular weight
313.2 g/mol

Vapor pressure est.

• hPa @ 20°C
• hPa @ 25°C

Evaporation rate
Ultra slow

Boiling point est.
450°C

Flash point

• 228.22 ˚C est.

• SCHEMBL258647

2-amino-3-[[(2R)-2-amino-2-carboxyethyl]disulfanyl]propanoic acid;dihydrochloride is a sulfur-containing amino acid derivative used as a pharmaceutical intermediate and a chiral building block for peptide synthesis; it can function as a reducing agent and antioxidant in cosmetic/personal care formulations; it may serve as a sulfur-containing precursor in fragrance and flavor chemistry; it can act as a crosslinking/functional additive in polymers and coatings via disulfide exchange; and it is employed as a reagent or intermediate in biochemical/analytical applications. The dihydrochloride salt improves water solubility for formulation and processing, and use is subject to local regulations and formulation limits.

gpt-5-nano

Solvent	Solubility (g/L)
ethanol	0.01
methanol	0.02
isopropanol	0.0
water	2.9
ethyl acetate	0.01
n-propanol	0.0
acetone	0.01
n-butanol	0.0
acetonitrile	0.0
DMF	0.22
toluene	0.01
isobutanol	0.0
1,4-dioxane	0.02
methyl acetate	0.0
THF	0.03
2-butanone	0.01
n-pentanol	0.0
sec-butanol	0.0
n-hexane	0.0
ethylene glycol	0.14
NMP	1.75
cyclohexane	0.01
DMSO	1.68
n-butyl acetate	0.02
n-octanol	0.01
chloroform	0.0
n-propyl acetate	0.01
acetic acid	0.17
dichloromethane	0.0
cyclohexanone	0.05
propylene glycol	0.06
isopropyl acetate	0.01
DMAc	0.57
2-ethoxyethanol	0.08
isopentanol	0.01
n-heptane	0.02
ethyl formate	0.01
1,2-dichloroethane	0.0
n-hexanol	0.01
2-methoxyethanol	0.14
isobutyl acetate	0.0
tetrachloromethane	0.0
n-pentyl acetate	0.01
transcutol	0.25
n-heptanol	0.02
ethylbenzene	0.01
MIBK	0.01
2-propoxyethanol	0.12
tert-butanol	0.01
MTBE	0.01
2-butoxyethanol	0.11
propionic acid	0.02
o-xylene	0.02
formic acid	1.54
diethyl ether	0.0
m-xylene	0.02
p-xylene	0.01
chlorobenzene	0.0
dimethyl carbonate	0.03
n-octane	0.01
formamide	0.9
cyclopentanone	0.06
2-pentanone	0.01
anisole	0.01
cyclopentyl methyl ether	0.03
gamma-butyrolactone	0.08
1-methoxy-2-propanol	0.11
pyridine	0.02
3-pentanone	0.01
furfural	0.26
n-dodecane	0.0
diethylene glycol	0.52
diisopropyl ether	0.01
tert-amyl alcohol	0.01
acetylacetone	0.06
n-hexadecane	0.0
acetophenone	0.04
methyl propionate	0.01
isopentyl acetate	0.02
trichloroethylene	0.01
n-nonanol	0.01
cyclohexanol	0.02
benzyl alcohol	0.02
2-ethylhexanol	0.02
isooctanol	0.02
dipropyl ether	0.02
1,2-dichlorobenzene	0.01
ethyl lactate	0.05
propylene carbonate	0.07
n-methylformamide	0.07
2-pentanol	0.01
n-pentane	0.0
1-propoxy-2-propanol	0.11
1-methoxy-2-propyl acetate	0.08
2-(2-methoxypropoxy) propanol	0.21
mesitylene	0.02
ε-caprolactone	0.05
p-cymene	0.03
epichlorohydrin	0.02
1,1,1-trichloroethane	0.0
2-aminoethanol	0.07
morpholine-4-carbaldehyde	0.64
sulfolane	1.09
2,2,4-trimethylpentane	0.0
2-methyltetrahydrofuran	0.02
n-hexyl acetate	0.01
isooctane	0.0
2-(2-butoxyethoxy)ethanol	0.21
sec-butyl acetate	0.01
tert-butyl acetate	0.03
decalin	0.01
glycerin	0.79
diglyme	0.3
acrylic acid	0.06
isopropyl myristate	0.01
n-butyric acid	0.03
acetyl acetate	0.02
di(2-ethylhexyl) phthalate	0.03
ethyl propionate	0.01
nitromethane	0.13
1,2-diethoxyethane	0.02
benzonitrile	0.01
trioctyl phosphate	0.02
1-bromopropane	0.0
gamma-valerolactone	0.22
n-decanol	0.01
triethyl phosphate	0.05
4-methyl-2-pentanol	0.01
propionitrile	0.0
vinylene carbonate	0.05
1,1,2-trichlorotrifluoroethane	0.25
DMS	0.03
cumene	0.01
2-octanol	0.01
2-hexanone	0.01
octyl acetate	0.01
limonene	0.04
1,2-dimethoxyethane	0.07
ethyl orthosilicate	0.05
tributyl phosphate	0.02
diacetone alcohol	0.13
N,N-dimethylaniline	0.04
acrylonitrile	0.01
aniline	0.01
1,3-propanediol	0.05
bromobenzene	0.0
dibromomethane	0.0
1,1,2,2-tetrachloroethane	0.01
2-methyl-cyclohexyl acetate	0.03
tetrabutyl urea	0.06
diisobutyl methanol	0.03
2-phenylethanol	0.03
styrene	0.01
dioctyl adipate	0.02
dimethyl sulfate	0.18
ethyl butyrate	0.02
methyl lactate	0.12
butyl lactate	0.07
diethyl carbonate	0.02
propanediol butyl ether	0.14
triethyl orthoformate	0.05
p-tert-butyltoluene	0.03
methyl 4-tert-butylbenzoate	0.14
morpholine	0.03
tert-butylamine	0.01
n-dodecanol	0.01
dimethoxymethane	0.06
ethylene carbonate	0.03
cyrene	0.49
2-ethoxyethyl acetate	0.03
2-ethylhexyl acetate	0.02
1,2,4-trichlorobenzene	0.01
4-methylpyridine	0.01
dibutyl ether	0.01
2,6-dimethyl-4-heptanol	0.03
DEF	0.06
dimethyl isosorbide	0.45
tetrachloroethylene	0.01
eugenol	0.15
triacetin	0.06
span 80	0.17
1,4-butanediol	0.03
1,1-dichloroethane	0.0
2-methyl-1-pentanol	0.01
methyl formate	0.04
2-methyl-1-butanol	0.0
n-decane	0.0
butyronitrile	0.0
3,7-dimethyl-1-octanol	0.01
1-chlorooctane	0.0
1-chlorotetradecane	0.0
n-nonane	0.0
undecane	0.0
tert-butylcyclohexane	0.0
cyclooctane	0.01
cyclopentanol	0.02
tetrahydropyran	0.01
tert-amyl methyl ether	0.01
2,5,8-trioxanonane	0.39
1-hexene	0.0
2-isopropoxyethanol	0.04
2,2,2-trifluoroethanol	0.22
methyl butyrate	0.01

Scent© AI