CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Colourless liquid with aroma and taste of grapefruit in dilute solution |
|---|---|
| Boiling Point | 37.00 °C. @ 0.10 mm Hg |
| Solubility | slightly soluble in water, soluble in fat |
| Density | 0.948 (20°) |
| Refractive Index | 1.504 |
| Kovats Retention Index | 1264 1291 |
COMPUTED DESCRIPTORS
| Molecular Weight | 170.32 g/mol |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 1 |
| Exact Mass | 170.11292175 g/mol |
| Monoisotopic Mass | 170.11292175 g/mol |
| Topological Polar Surface Area | 1 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 168 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
2-(4-Methylcyclohex-3-en-1-yl)propane-2-thiol is a p-menthane monoterpenoid.