| Melting point |
80-810C |
| Boiling point |
469.8±35.0 °C(Predicted) |
| Density |
1.177±0.06 g/cm3(Predicted) |
| storage temp. |
room temp |
| solubility |
Practically insoluble in water, very soluble in methylene chloride, slightly soluble in ethanol (96 per cent) |
| form |
powder |
| color |
off-white |
| Water Solubility |
0.8mg/L(25 ºC) |
| Merck |
14,3978 |
| Henry's Law Constant |
2.2×103 mol/(m3Pa) at 25℃, HSDB (2015) |
| BCS Class |
2 |
| Major Application |
forensics and toxicology
pharmaceutical (small molecule) |
| InChI |
InChI=1S/C20H21ClO4/c1-13(2)24-19(23)20(3,4)25-17-11-7-15(8-12-17)18(22)14-5-9-16(21)10-6-14/h5-13H,1-4H3 |
| InChIKey |
YMTINGFKWWXKFG-UHFFFAOYSA-N |
| SMILES |
C(OC(C)C)(=O)C(OC1=CC=C(C(=O)C2=CC=C(Cl)C=C2)C=C1)(C)C |
| EPA Substance Registry System |
Propanoic acid, 2-[4-(4-chlorobenzoyl)phenoxy]-2-methyl-, 1-methylethyl ester (49562-28-9) |
