110488-70-5
| Name | Dimethomorph |
| CAS | 110488-70-5 |
| EINECS(EC#) | 404-200-2 |
| Molecular Formula | C21H22ClNO4 |
| MDL Number | MFCD01632781 |
| Molecular Weight | 387.86 |
| MOL File | 110488-70-5.mol |
Chemical Properties
| Melting point | 125-149°C |
| Boiling point | 584.9±50.0 °C(Predicted) |
| density | 1.231±0.06 g/cm3(Predicted) |
| vapor pressure | 1 x 10-6 Pa (25 °C) |
| storage temp. | 0-6°C |
| solubility | Chloroform: Soluble,Methanol: Soluble |
| form | neat |
| pka | -1.19±0.20(Predicted) |
| Water Solubility | 50 mg l-1 (20-23 °C) |
| color | White to off-white |
| Merck | 13,3248 |
| BRN | 8794474 |
| Henry's Law Constant | 4.9×104 mol/(m3Pa) at 25℃, Duchowicz et al. (2020) |
| Major Application | agriculture environmental |
| InChI | 1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+ |
| InChIKey | QNBTYORWCCMPQP-NBVRZTHBSA-N |
| SMILES | COc1ccc(cc1OC)\C(=C\C(=O)N2CCOCC2)c3ccc(Cl)cc3 |
| LogP | 2.680 |
| EPA Substance Registry System | Morpholine, 3-(3-(4-chlorophenyl)-3-(3, 4-dimethoxyphenyl)-1-oxo- 2-propenyl)-(110488-70-5) |
Safety Data
| Symbol(GHS) |   GHS08,GHS09 |
| Signal word | Danger |
| Hazard statements | H360F-H411 |
| Precautionary statements | P202-P273-P280-P308+P313-P391-P405 |
| Hazard Codes | N |
| Risk Statements | |
| Safety Statements | |
| RIDADR | UN3077 9/PG 3 |
| WGK Germany | 2 |
| RTECS | QE0478300 |
| REACH Registrations | Active |
| Storage Class | 6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects |
| Hazard Classifications | Aquatic Chronic 2 Repr. 1B |
| Hazardous Substances Data | 110488-70-5(Hazardous Substances Data) |
| Toxicity |