| Formula |
C12H14F5N3O4S |
| IUPAC Name |
3-[[5-(difluoromethoxy)-1-methyl-3-(trifluoromethyl)pyrazol-4-yl]methylsulfonyl]-5,5-dimethyl-4h-isoxazole |
| Molecular Mass |
391.314 g·mol−1 |
| Heat of Formation |
-1421.3 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.28 ± 1.08 D |
| Volume |
388.15 Å 3 |
| Surface Area |
333.13 Å 2 |
| HOMO Energy |
-10.11 ± 0.55 eV |
| LUMO Energy |
-0.80 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 5-(difluoromethoxy)-4-[(5,5-dimethyl-4h-1,2-oxazol-3-yl)sulfonylmethyl]-1-methyl-3-(trifluoromethyl)pyrazole
- 5-(difluoromethoxy)-4-[(5,5-dimethyl-4h-isoxazol-3-yl)sulfonylmethyl]-1-methyl-3-(trifluoromethyl)pyrazole
|
| InChIKey |
CASLETQIYIQFTQ-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
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|
| DOI |
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| Downloads |
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|
| Elements |
C
F
H
O
N
S
|
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