Pubchem ID | 62128 |
---|---|
CAS | 57124-87-5 |
IUPAC name | 2-methyloxolane-3-thiol |
Synonyms | 2-Methyltetrahydrofuran-3-thiol|2-Methyl-3-tetrahydrofuranthiol|2-methyloxolane-3-thiol|Tetrahydro-2-methyl-3-furanthiol|3-Furanthiol, tetrahydro-2-methyl- |
Categories | Flavor enhancer |
SMILES | CC1C(CCO1)S |
InCheykey | InChI=1S/C5H10OS/c1-4-5(7)2-3-6-4/h4-5,7H,2-3H2,1H3 |
Natural | YES |
E No. | - |
GHS Siginal | - |
ADI Value | - |
Molecular weight | Hydrogen Bond Donor count | Hydrogen Bond Acceptor count | Rotatable bonds | Topological Polor Surface Area |
---|---|---|---|---|
118.194 | 1 | 2 | 0 | 10.2 |
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 |
---|---|---|---|---|---|---|
Non-Carcinogen | Non-Toxic | Non-Mutagen | Irritant | Non-Irritant | Irritant | Degradable |