PUBCHEM ID | 62333 |
Molecular Weight (mg/mol) | 206.2 |
Molecular Formula | C8H14O6 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 0 |
IUPAC Name | Diethyltartrate |
Canonical SMILES | CCOC(=O)[C@@H](O)[C@H](O)C(=O)OCC |
PUBCHEM IUPAC INCHIKEY | YSAVZVORKRDODB-WDSKDSINSA-N |
Solubility Level | 5 |
Vapour Pressure | -4.631 |
XLOGP3 AA | NA |
CACTVS TPSA | 24.06 |
BBB Level | 3 |
Absorption Level | 0 |
EXT PPB#Prediction | 0 |
AlogP98 | -0.515 |
EXT CYP2D6#Prediction | 0 |
Mouse Female FDA | Single-Carcinogen |
Mouse Male FDA | Multi-Carcinogen |
Rat Female FDA | Non-Carcinogen |
Rat Male FDA | Non-Carcinogen |
Ames Prediction | Non-Mutagen |
Developmental / Reproductive Toxicity | Toxic |
Rat Oral LD50 | 5.05877 |
Ocular Irritancy | Mild |
Hepatotoxic#Prediction | 0 |
Effected Human Genes | NA |
Aerobic Biodegradability Prediction | Degradable |
Physical hazards | not classified |
Health hazards | None |
Environmental hazards | not classified |
Serial No. | Cas No | Gene Symbol | Organism | Interaction | Interaction Actions | PubMed Id |
---|---|---|---|---|---|---|
1 | 13811-71-7 | |||||
2 | 13811-71-7 |
Serial No. | Activity Name | Details | References (PubMed) | Other details EPA (U.S) | Clinical Trials (U.S. NIH) |
---|---|---|---|---|---|
1 | 13811-71-7 | Diethyl 2,3-dihydroxysuccinate |