Tricyclene Details
:
IUPAC Name
6,7,7-trimethyl-2,3,4,5-tetrahydro-1H-tricyclo[2.2.1.0^{2,6}]heptane
:Chemical Class
Alkane
:CAS Registry Number
508-32-7
:Description
:Fragrance Type
Physical and Chemical properties
| PUBCHEM ID | 79035 |
| Molecular Weight (g/mol) | 136.234 |
| Molecular Formula | C10H16 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 0 |
| Rotatable Bond Count | 0 |
| IUPAC Name | 6,7,7-trimethyl-2,3,4,5-tetrahydro-1H-tricyclo[2.2.1.0^{2,6}]heptane |
| Canonical SMILES | CC3(C)C1CC2C(C1)C23C |
| PUBCHEM IUPAC INCHIKEY | RRBYUSWBLVXTQN-UHFFFAOYSA-N |
| Solubility Level | 3 |
| Vapour Pressure | 0.269 |
Absorption and Metabolism information
| XLOGP3 AA | 3.2 |
| CACTVS TPSA | 0 |
| BBB Level | 1 |
| Absorption Level | 1 |
| EXT PPB#Prediction | 1 |
| AlogP98 | 2.296 |
| EXT CYP2D6#Prediction | 0 |
Toxicological Information
| Mouse Female FDA | Multi-Carcinogen |
| Mouse Male FDA | Multi-Carcinogen |
| Rat Female FDA | Single-Carcinogen |
| Rat Male FDA | Multi-Carcinogen |
| Ames Prediction | Non-Mutagen |
| Developmental / Reproductive Toxicity | Toxic |
| Rat Oral LD50 | 1.7461 g/kg_body_weight |
| Ocular Irritancy | Mild |
| Hepatotoxic#Prediction | 0 |
| Effected Human Genes |
Ecological Information
| Aerobic Biodegradability Prediction | Non-Degradable |
Hazard(s) Identification
| Physical hazards | not classified |
| Health hazards | Moderate |
| Environmental hazards | not classified |
