PUBCHEM ID | 16441 |
Molecular Weight (mg/mol) | 150.222 |
Molecular Formula | C10H14O |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 8 |
IUPAC Name | p-Mentha-1,8-dien-7-al |
Canonical SMILES | C=C(C)[C@@H]1C/C=C(C=O)CC1 |
PUBCHEM IUPAC INCHIKEY | RUMOYJJNUMEFDD-SNVBAGLBSA-N |
Solubility Level | 3 |
Vapour Pressure | -0.812 |
XLOGP3 AA | NA |
CACTVS TPSA | 18.46 |
BBB Level | 1 |
Absorption Level | 0 |
EXT PPB#Prediction | 1 |
AlogP98 | 2.668 |
EXT CYP2D6#Prediction | 0 |
Mouse Female FDA | Multi-Carcinogen |
Mouse Male FDA | Multi-Carcinogen |
Rat Female FDA | Single-Carcinogen |
Rat Male FDA | Single-Carcinogen |
Ames Prediction | Non-Mutagen |
Developmental / Reproductive Toxicity | Non-Toxic |
Rat Oral LD50 | 1.5906 |
Ocular Irritancy | Mild |
Hepatotoxic#Prediction | 0 |
Effected Human Genes | NA |
Aerobic Biodegradability Prediction | Degradable |
Physical hazards | not classified |
Health hazards | Moderate |
Environmental hazards | not classified |
Serial No. | Cas No | Gene Symbol | Organism | Interaction | Interaction Actions | PubMed Id |
---|---|---|---|---|---|---|
1 | 18031-40-8 |
Serial No. | Activity Name | Details | References (PubMed) | Other details EPA (U.S) | Clinical Trials (U.S. NIH) |
---|---|---|---|---|---|
1 | 18031-40-8 | Perillyl aldehyde |