Pubchem ID | 10484 |
---|---|
CAS | 507-09-5 |
IUPAC name | ethanethioic S-acid |
Synonyms | Ethanethioic acid|Thiacetic acid|Ethanethioic S-acid|Thiolacetic acid|Thioacetic S-acid|Acetyl mercaptan|Ethanethiolic acid|Thionoacetic acid|Methanecarbothiolic acid |
Categories | Flavor enhancer |
SMILES | CC(=O)S |
InCheykey | InChI=1S/C2H4OS/c1-2(3)4/h1H3,(H,3,4) |
Natural | nan |
E No. | - |
GHS Siginal | - |
ADI Value | - |
Molecular weight | Hydrogen Bond Donor count | Hydrogen Bond Acceptor count | Rotatable bonds | Topological Polor Surface Area |
---|---|---|---|---|
76.113 | 1 | 2 | 0 | 18.1 |
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 | Medium | Non - Inhibitor | Toxic |
Carcinogenicity | Developmental Toxicity | Mutagenicity (Ames) | Skin Irritancy | Skin Sensitization | Ocular Irritancy | Aerobic Biodegradability |
---|---|---|---|---|---|---|
Carcinogen | Toxic | Non-Mutagen | Irritant | Irritant | Irritant | Degradable |