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Flusilazole
CAS: 85509-19-9 | C16H15F2N3Si
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
85509-19-9
Molecular Formula:
C16H15F2N3Si
Molecular Mass:
315.40 g/mol
Names and Synonyms:
Flusilazole
1H-1,2,4-Triazole, 1-[[bis(4-fluorophenyl)methylsilyl]methyl]-
1-[[Bis(4-fluorophenyl)methylsilyl]methyl]-1H-1,2,4-triazole
DPX-H 6573
Flusilazole
Flusilazol
Punch
Punch (pesticide)
Nustar
DPD 78710F
DPX-N 6573
Punch 40EC
Lyric
Olymp
Olymp 10EX
Sanction
Benocarp
Punch Bis
Capitan
Cane Strike
Cursor
Bis(4-fluorophenyl)methyl(1H-1,2,4-triazole-1-ylmethyl)silane
Genie
Genie (fungicide)
Genie 25
Identifiers:
SMILES:
C[Si](Cn1cncn1)(c1ccc(F)cc1)c1ccc(F)cc1
InChI:
InChI=1S/C16H15F2N3Si/c1-22(12-21-11-19-10-20-21,15-6-2-13(17)3-7-15)16-8-4-14(18)5-9-16/h2-11H,12H2,1H3
Key Properties
Boiling Point
393.00 °C
CAS Common Chemistry
Melting Point
54 °C
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 315.40 g/mol | CAS Common Chemistry |
| 315.399 g/mol | RDKit | |
| 315.10033045 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Flusilazole | CAS Common Chemistry |
| Boiling Point | 393.00 °C | CAS Common Chemistry |
| Canonical SMILES | FC1=CC=C(C=C1)[Si](C2=CC=C(F)C=C2)(C)CN3N=CN=C3 | CAS Common Chemistry |
| InChI | InChI=1S/C16H15F2N3Si/c1-22(12-21-11-19-10-20-21,15-6-2-13(17)3-7-15)16-8-4-14(18)5-9-16/h2-11H,12H2,1H3 | CAS Common Chemistry |
| InChI Key | InChIKey=FQKUGOMFVDPBIZ-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 54 °C | CAS Common Chemistry |
| Name | Flusilazole | CAS Common Chemistry |
| Heavy Atom Count | 22 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 4 | RDKit |
| Aromatic Ring Count | 3 | RDKit |
| Topological Polar Surface Area | 30.71 Ų | RDKit |
| LogP | 1.9885 | RDKit |
| Molar Refractivity | 83.70800000000001 | RDKit |
