Compound Summary
spirodiclofen
Compound Information
spirodiclofen
Compound Name: | spirodiclofen |
Compound CID: | 177863 |
Synonyms: | spirodiclofen 148477-71-8 UNII-3X7G31F5MX 3-(2,4-dichlorophenyl)-2-oxo-1-oxaspiro4.5dec-3-en-4-yl 2,2-dimethylbutanoate 3X7G31F5MX More... |
Iupac Name: | [3-(2,4-dichlorophenyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl] 2,2-dimethylbutanoate |
InChI: | InChI=1S/C21H24Cl2O4/c1-4-20(2,3)19(25)26-17-16(14-9-8-13(22)12-15(14)23)18(24)27-21(17)10-6-5-7-11-21/h8-9,12H,4-7,10-11H2,1-3H3 |
InChIKey: | DTDSAWVUFPGDMX-UHFFFAOYSA-N |
Canonical Smiles: | CCC(C)(C)C(=O)OC1=C(C(=O)OC12CCCCC2)C3=C(C=C(C=C3)Cl)Cl |
Isomeric Smiles: | CCC(C)(C)C(=O)OC1=C(C(=O)OC12CCCCC2)C3=C(C=C(C=C3)Cl)Cl |
Molecular Weight: | 411.3 |
Molecular Formula: | C21H24Cl2O4 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
spirodiclofen
Molecular Weight: | 411.3 |
Molecular Formula: | C21H24Cl2O4 |
Hydrogen Bond Donor Count: | 0 |
Hydrogen Bond Acceptor Count: | 4 |
Rotatable Bond Count: | 5 |
Heavy Atom Count: | 27 |
Complexity: | 634 |
Synonyms
spirodiclofen
| spirodiclofen | spirodiclofen |
|---|---|
spirodiclofen |
148477-71-8 |
UNII-3X7G31F5MX |
3-(2,4-dichlorophenyl)-2-oxo-1-oxaspiro4.5dec-3-en-4-yl 2,2-dimethylbutanoate |
3X7G31F5MX |
CHEBI:38639 |
BAJ-2740 |
3-(2,4-dichlorophenyl)-2-oxo-1-oxaspiro4.5dec-3-en-4-yl 2,2-dimethylbutanoate |
Envidor |
Spirodiclofen ISO |
HSDB 7940 |
BAJ 2740 |
SCHEMBL27234 |
CHEMBL2227839 |
DTXSID6034928 |
BAJ2740 |
BCP21407 |
HY-B0826 |
YFA47771 |
ZINC2540062 |
AKOS015895782 |
CS-5165 |
NCGC00182605-01 |
Spirodiclofen 1000 microg/mL in Acetone |
Spirodiclofen 10 microg/mL in Cyclohexane |
FT-0631177 |
C18553 |
31444-EP2274983A1 |
31444-EP2275422A1 |
31444-EP2308858A1 |
31444-EP2311816A1 |
31444-EP2311817A1 |
Spirodiclofen, PESTANAL(R), analytical standard |
477S718 |
A808770 |
Q425807 |
J-008475 |
2,2-dimethylbutanoic acid 2-(3,5-dichlorophenyl)-3-oxo-4-oxaspiro4.5dec-1-en-1-yl ester |
Butanoic acid, 2,2-dimethyl-, 3-(2,4-dichlorophenyl)-2-oxo-1-oxaspiro(4.5)dec-3-en-4-yl ester |
Pesticide7_Spirodiclofen_C21H24Cl2O4_Butanoic acid, 2,2-dimethyl-, 3-(2,4-dichlorophenyl)-2-oxo-1-oxaspiro4.5dec-3-en-4-yl ester |
Experimental Data
spirodiclofen
| Species | Dose | Unit | Control(Avg days) | Treatment(Avg days) | Avg/Med Lifespan Change(%) | Control(Max days) | Treatment(Max days) | Max Lifespan Change(%) | Significant | Strain | Gender | PubMed | Avg/Med Lifespan Change tab |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Oligota flavicornis | 30.000000000000000 | mg/L | 55.850000000000000 | 56.950000000000000 | 0.020000000000000 | NS | FEMALES | 30066468 | Inactive | ||||
| Oligota flavicornis | 60.000000000000000 | mg/L | 55.850000000000000 | 49.520000000000000 | -0.110000000000000 | NS | FEMALES | 30066468 | Inactive | ||||
| Oligota flavicornis | 30.000000000000000 | mg/L | 58.690000000000000 | 60.130000000000000 | 0.020000000000000 | NS | MALES | 30066468 | Inactive | ||||
| Oligota flavicornis | 120.000000000000000 | mg/L | 55.850000000000000 | 51.150000000000000 | -0.080000000000000 | NS | FEMALES | 30066468 | Inactive | ||||
| Oligota flavicornis | 120.000000000000000 | mg/L | 58.690000000000000 | 43.710000000000000 | -0.260000000000000 | S | MALES | 30066468 | Inactive | ||||
| Oligota flavicornis | 60.000000000000000 | mg/L | 58.690000000000000 | 40.560000000000000 | -0.310000000000000 | S | MALES | 30066468 | Inactive | ||||
| Brevipalpus yothersi | 0.480000000000000 | ppm | 24.250000000000000 | 24.050000000000000 | -0.010000000000000 | NS | 31840413 | Inactive |
Experimental Data Visualization
spirodiclofen
Statistics Data
spirodiclofen
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Brevipalpus yothersi | -0.010000000000000 | 1 | 1 | |
| Oligota flavicornis | 0.020000000000000 | 1 | 6 |
Statistics Data Visualization
spirodiclofen
