| Melting point |
80-85°C |
| Boiling point |
367.5±22.0 °C(Predicted) |
| Density |
1.119±0.06 g/cm3(Predicted) |
| storage temp. |
-20°C Freezer |
| solubility |
Acetonitrile (Slightly), Chloroform (Slightly, Heated), Methanol (Slightly) |
| pka |
4.39±0.10(Predicted) |
| color |
White to Off-White |
| BRN |
22307543 |
| Major Application |
forensics and toxicology
pharmaceutical (small molecule) |
| InChI |
InChI=1S/C13H18O3/c1-8(2)12(14)11-6-4-10(5-7-11)9(3)13(15)16/h4-9,12,14H,1-3H3,(H,15,16) |
| InChIKey |
RMOQYHYFRKTDRI-UHFFFAOYSA-N |
| SMILES |
C1(C(C)C(O)=O)=CC=C(C(O)C(C)C)C=C1 |
| FDA UNII |
8A1S87ZA87 |
| UNSPSC Code |
41116107 |
| NACRES |
NA.24 |
