Pubchem ID | 13367 |
---|---|
CAS | 870-23-5 |
IUPAC name | prop-2-ene-1-thiol |
Synonyms | 2-Propene-1-thiol|Allylthiol|prop-2-ene-1-thiol|Allylmercaptan|Allyl sulfhydrate |
Categories | Flavor enhancer |
SMILES | C=CCS |
InCheykey | InChI=1S/C3H6S/c1-2-3-4/h2,4H,1,3H2 |
Natural | YES |
E No. | - |
GHS Siginal | Danger |
ADI Value | - |
Molecular weight | Hydrogen Bond Donor count | Hydrogen Bond Acceptor count | Rotatable bonds | Topological Polor Surface Area |
---|---|---|---|---|
74.141 | 1 | 1 | 1 | 1.0 |
Human Intestinal Absorption | Aqueous Solubility Level | Plasma Protein Binding Level | Blood Brain Barrier Penetration | CYP2DE Binding Level | Hepatotoxicity Level |
---|---|---|---|---|---|
Moderate Absorption | Optimal Solubility | Weaker / Non binder | Undefined | Non - Inhibitor | Toxic |
Carcinogenicity | Developmental Toxicity | Mutagenicity (Ames) | Skin Irritancy | Skin Sensitization | Ocular Irritancy | Aerobic Biodegradability |
---|---|---|---|---|---|---|
Carcinogen | Non-Toxic | Non-Mutagen | Irritant | Irritant | Irritant | Degradable |