PUBCHEM ID | 244 |
CAS Registry Number | 0.0 |
Aroma Threshold | 0.0 |
Molecular Weight (g/mol) | 108.138 |
Molecular Formula | C7H8O |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 1 |
Rotatable Bond Count | 1 |
IUPAC Name | phenylmethanol |
Canonical SMILES | OCc1ccccc1 |
PUBCHEM IUPAC INCHIKEY | WVDDGKGOMKODPV-UHFFFAOYSA-N |
Solubility Level | 4 |
Vapour Pressure |
XLOGP3 AA | |
CACTVS TPSA | 20.2 |
BBB Level | 2 |
Absorption Level | 0 |
EXT PPB#Prediction | 1 |
AlogP98 | 1.225 |
EXT CYP2D6#Prediction | 0 |
Mouse Female FDA | Multi-Carcinogen |
Mouse Male FDA | Multi-Carcinogen |
Rat Female FDA | Multi-Carcinogen |
Rat Male FDA | Non-Carcinogen |
Ames Prediction | Non-Mutagen |
Developmental / Reproductive Toxicity | Toxic |
Rat Oral LD50 | 1.60213 g/kg_body_weight |
Ocular Irritancy | Severe |
Hepatotoxic#Prediction | 0 |
Effected Human Genes |
Aerobic Biodegradability Prediction | Degradable |
Physical hazards | not classified |
Health hazards | Mild |
Environmental hazards | not classified |
Serial No. | Activity Name | Details | References (PubMed) | Other details EPA (U.S) | Clinical Trials (U.S. NIH) |
---|---|---|---|---|---|
1 | 100-51-6 | Benzyl Alcohol |
Serial No. | Plant Name | Variety Name | Essential Oil | Compound Percentage |
---|---|---|---|---|
1 | Horsechestnut | Aesculus hippocastanum essential oil | ||
2 | Jasmin | Jasminum sambac essential oil | ||
3 | Rose, Damask Rose | Noorjahan | Rosa damascena Noorjahan essential oil | |
4 | Rose, Damask Rose | Ranisahiba | Rose Ranisahiba essential oil | |
5 | Garden heliotrope | Heliotropium floridum essential oil | ||
6 | Lemon verbena | Aloysia citrodora essential oil |