Food Additive Profile
Pubchem ID 106217
CAS 67952-60-7
IUPAC name 2-methyl-2-(methyldisulfanyl)propanal
Synonyms -
Categories Flavor enhancer
SMILES CC(C)(C=O)SSC
InCheykey InChI=1S/C5H10OS2/c1-5(2,4-6)8-7-3/h4H,1-3H3
Natural YES
E No. -
GHS Siginal -
ADI Value -

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Physicochemical Properties
Molecular weight Hydrogen Bond Donor count Hydrogen Bond Acceptor count Rotatable bonds Topological Polor Surface Area
150.254 0 3 3 67.7

*Prediction Method

ADME Predicted Parameters
Human Intestinal Absorption Aqueous Solubility Level Plasma Protein Binding Level Blood Brain Barrier Penetration CYP2DE Binding Level Hepatotoxicity Level
Good Absorption Optimal Solubility Weaker / Non binder High Non - Inhibitor Non Toxic

*Prediction Method

Toxicity Predicted Parameters
Carcinogenicity Developmental Toxicity Mutagenicity (Ames) Skin Irritancy Skin Sensitization Ocular Irritancy Aerobic Biodegradability
Non-Carcinogen Non-Toxic Non-Mutagen Irritant Irritant Non-Irritant Degradable

References




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