CAS Number110488-70-5
SynonymsACROBAT; (2Ξ)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-(morpholin-4-yl)prop-2-en-1-one; MFCD01632781; Dimethoroph; 4-[3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-oxo-2-propen-1-yl]morpholine; (2E)-3-(4-Chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-(morpholin-4-yl)prop-2-en-1-one; CME 151; Akrobat; (2E)-3-(4-Chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-(4-morpholinyl)-2-propen-1-one; Forum; dimethomoph; EINECS 404-200-2; (2E)-3-(4-Chlorphenyl)-3-(3,4-dimethoxyphenyl)-1-(morpholin-4-yl)prop-2-en-1-on; (EZ)-4-[3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)acryloyl]morpholine; Festival C; Z-DIMETHOMORPH; AcrobatWP; 4-[(2E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]morpholine; Dimethomorph; 3-(4-Chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholinoprop-2-en-1-one
Molecular FormulaC21H22ClNO4
Molecular Weight387.86
Purity98.00%
Density1.2±0.1 g/cm3
Boiling Point584.9±50.0 °C at 760 mmHg
Melting Point125-149ºC
EINECS404-200-2
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 110488-70-5 |
| Catalog No. | 2A-9010179 |
| Chinese Name | 烯酰吗啉 |
| Synonyms | ACROBAT; (2Ξ)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-(morpholin-4-yl)prop-2-en-1-one; MFCD01632781; Dimethoroph; 4-[3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-oxo-2-propen-1-yl]morpholine; (2E)-3-(4-Chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-(morpholin-4-yl)prop-2-en-1-one; CME 151; Akrobat; (2E)-3-(4-Chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-(4-morpholinyl)-2-propen-1-one; Forum; dimethomoph; EINECS 404-200-2; (2E)-3-(4-Chlorphenyl)-3-(3,4-dimethoxyphenyl)-1-(morpholin-4-yl)prop-2-en-1-on; (EZ)-4-[3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)acryloyl]morpholine; Festival C; Z-DIMETHOMORPH; AcrobatWP; 4-[(2E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]morpholine; Dimethomorph; 3-(4-Chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholinoprop-2-en-1-one |
| Molecular Formula | C21H22ClNO4 |
| Molecular Weight | 387.86 |
| Purity | 98.00 |
| Density | 1.2±0.1 g/cm3 |
| Boiling Point | 584.9±50.0 °C at 760 mmHg |
| Melting Point | 125-149ºC |
| Storage Condition | Sealed and stored in a cool, dry warehouse. |
| Packaging | III |
| Application | Dimetholine is a morpholine fungicide that inhibits fungal cell wall formation. Dimethomorph inhibits the mycelial growth of the oomycetes P.citrophthora, P.parasitica, P.capsici and P.infestans (EC50 |
| EINECS | 404-200-2 |
| PubChem ID | 329757062 |
| MDL Number | MFCD01632781 |
| SMILES | COc1ccc(cc1OC)\C(=C\C(=O)N2CCOCC2)c3ccc(Cl)cc3 |
| 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+ |
| InChI Key | QNBTYORWCCMPQP-NBVRZTHBSA-N |
| Beilstein/REAXYS | 8794474 |
| NACRES Code | NA.24 |
| UNSPSC | 41116107 |
| Hazard Symbols | Transport |
| MSDS | msds/10179_1_110488_70_5.pdf |
| Bioactivity | Dimethomorph is a morpholine fungicide that inhibits fungal cell wall formation. Dimethomorph inhibits mycelial growth of the oomycete fungi P. citrophthora, P. parasitica, P. capsici, and P. infestans (EC50s=0.14 µg/mL, 0.38 µg/mL, <0.1 µg/mL, and 0.16-0.3 µg/mL, respectively) but is less active against the green algae species C. vulgaris or S. obliquus in vitro (EC50s=47.46 µg/mL and 44.87 µg/mL, respectively). Dimethomorph inhibits androgen receptor (AR) activity in a reporter assay in MDA-kb2 human breast cancer cells but not in a yeast antiandrogen screen (IC20s=0.263 µM and 38.5 µM, respectively). Related Catalog Signaling Pathways >> Anti-infection >> Fungal Signaling Pathways >> Others >> Androgen Receptor Chemical & Physical Properties Density 1.2±0.1 g/cm3 Boiling Point 584.9±50.0 °C at 760 mmHg Melting Point 125-149ºC Molecular Formula C21H22ClNO4 Molecular Weight 387.857 Flash Point 307.5±30.1 °C Exact Mass 387.123749 PSA 48.00000 LogP 3.71 Vapour Pressure 0.0±1.6 mmHg at 25°C Index of Refraction 1.581 InChIKey QNBTYORWCCMPQP-UHFFFAOYSA-N SMILES COc1ccc(C(=CC(=O)N2CCOCC2)c2ccc(Cl)cc2)cc1OC Storage condition 0-6°C |
| Use of | Dimethomorph is a morpholine fungicide that inhibits fungal cell wall formation. Dimethomorph inhibits mycelial growth of the oomycete fungi P. citrophthora, P. parasitica, P. capsici, and P. infestans (EC50s=0.14 µg/mL, 0.38 µg/mL, <0.1 µg/mL, and 0.16-0.3 µg/mL, respectively) but is less active against the green algae species C. vulgaris or S. obliquus in vitro (EC50s=47.46 µg/mL and 44.87 µg/mL, respectively). Dimethomorph inhibits androgen receptor (AR) activity in a reporter assay in MDA-kb2 human breast cancer cells but not in a yeast antiandrogen screen (IC20s=0.263 µM and 38.5 µM, respectively). Properties Articles25 Name dimethomorph Synonym More Synonyms dimethomorph Biological Activity Description Dimethomorph is a morpholine fungicide that inhibits fungal cell wall formation. Dimethomorph inhibits mycelial growth of the oomycete fungi P. citrophthora, P. parasitica, P. capsici, and P. infestans (EC50s=0.14 µg/mL, 0.38 µg/mL, <0.1 µg/mL, and 0.16-0.3 µg/mL, respectively) but is less active against the green algae species C. vulgaris or S. obliquus in vitro (EC50s=47.46 µg/mL and 44.87 µg/mL, respectively). Dimethomorph inhibits androgen receptor (AR) activity in a reporter assay in MDA-kb2 human breast cancer cells but not in a yeast antiandrogen screen (IC20s=0.263 µM and 38.5 µM, respectively). Related Catalog Signaling Pathways >> Anti-infection >> Fungal Signaling Pathways >> Others >> Androgen Receptor Chemical & Physical Properties Exact Mass 387.123749 PSA 48.00000 Index of Refraction 1.581 InChIKey QNBTYORWCCMPQP-UHFFFAOYSA-N |
| Transport Info | Product name: Purity: 98.0% |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Land Transport Danger Regulations: 3077 International Maritime Transport Danger Regulations: 3077 International Air Transport Danger Regulations: 3077 14.2 Names specified by the United Nations (UN) European land transport hazard regulations: ENVIRONMENTALLY HAZARDOUS SUBSTANCE, SOLID, N.O.S. (4-(3-(4-Chlorophenyl)- 3-(3,4-dimethoxyphenyl)acryloyl)morpholine) IMDG: ENVIRONMENTALLY HAZARDOUS SUBSTANCE, SOLID, N.O.S. (4-(3-(4-Chlorophenyl)- 3-(3,4-dimethoxyphenyl)acryloyl)morpholine) International air transport hazard regulations: Environmentally hazardous substance, solid, n.o.s. (4-(3-(4-Chlorophenyl)-3-(3,4- dimethoxyphenyl)acryloyl)morpholine) 14.3 Transport hazard categories European land transport Dangerous Regulations: 9 International sea transport Dangerous Regulations: 9 International air transport Dangerous Regulations: 9 14.4 Package group European Land Transport Danger Regulations: III International Maritime Transport Danger Regulations: III International Air Transport Danger Regulations: III 14.5 Environmental hazards European Land Transport Dangerous Regulations: Yes International Maritime Transport Dangerous Regulations Maritime Pollutants: Yes International Air Transport Dangerous Regulations: Yes 14.6 Special reminder to users further information Dangerous goods are individually packaged, with liquids exceeding 5 liters or solids exceeding 5 kilograms. The outer packaging of each independent package and the combined independent inner package must have EHS on it. Identification (according to European ADR Regulation 2.2.9.1.10, IMDG Regulation 2.10.3), |
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