ISOPROCARB


UNII	714I55QH9K
Source	Gaulton A, Kale N, van Westen GJ, Bellis LJ, Bento AP, Davies M, Hersey A, Papadatos G, Forster M, Wege P, Overington JP. A large-scale crop protection bioassay data set. Sci Data. 2015 Jul 7;2:150032. Read more ...


Active Pharmaceutical Ingredients Bioactive chemicals	Exact Similarity SubStructure	Threshold (%) >= 70

Structure


InChI Key	QBSJMKIUCUGGNG-UHFFFAOYSA-N
Smiles	CNC(=O)Oc1ccccc1C(C)C
InChI	InChI=1S/C11H15NO2/c1-8(2)9-6-4-5-7-10(9)14-11(13)12-3/h4-8H,1-3H3,(H,12,13)

Physicochemical Descriptors

Property Name	Value
Molecular Formula	C11H15NO2
Molecular Weight	193.24
AlogP	2.79
Hydrogen Bond Acceptor	2.0
Hydrogen Bond Donor	1.0
Number of Rotational Bond	3.0
Polar Surface Area	38.33
Molecular species	NEUTRAL
Aromatic Rings	1.0
Heavy Atoms	14.0

Reference

Journal : Crop Protection

Title : Assessment of the impact of insecticides on Anagrus nilaparvatae (Pang et Wang) (Hymenoptera: Mymanidae), an egg parasitoid of the rice planthopper, Nilaparvata lugens (Hemiptera: Delphacidae)

DOI : 10.1016/j.cropro.2007.08.004

Year : 2008

Volume : 27

Issue : 3

First Page : 514

Last Page : 522

Authors : Wang HuaiYin, Yang Yang, Su JianYa, Shen JinLiang, Gao CongFen, Zhu YuCheng.

Abstract : The parasitoid, Anagrus nilaparvatae (Pang et Wang), is a major natural enemy of the rice planthopper Nilaparvata lugens. It plays an important role in the integrated pest management (IPM) of the rice planthopper, although chemical control is also effective. However, compatibility of biological and chemical control has never been investigated with this system. This study was designed to assess potential insecticide toxicities to the wasps, including acute and residual toxicity through contact and oral ingestion. Fourteen insecticides, including organophosphates, carbamates, pyrethroids, insect growth regulators (IGRs), neonicotine, phenylpyrazole, and antibiotics were selected to test their toxicities against the adult parasitoid. Median lethal concentration (LC₅₀) of each insecticide was first determined. Acute contact toxicity tests indicated that chlorpyrifos had the highest toxicity to the wasp, requiring the least chemical to achieve 50% mortality. Imidacloprid was the second most toxic insecticide, while IGRs had the lowest toxicity. Results of oral toxicity tests of 14 pesticides showed that dichlorvos was the most toxic, which generated 100% mortality only 2h after treatment. Isoprocarb, imidacloprid, and thiamethoxam were the second most toxic insecticides and killed all wasps in a 4-h period. Residual toxicity results indicated that imidacloprid was the most persistent insecticide, and it retained residual toxicity (80.7% mortality) on rice leaves up to 7d after treatment. Thiamethoxam, triazophos, and fipronil also had long residual toxicity to the wasps with 7-d mortalities as 66.8%, 54.6%, and 50.0%, respectively. IGRs showed very low contact and residual toxicity, but exhibited certain chronic effects of oral toxicity on longevity, fecundity, and offspring emergence.

Reference

Journal : Crop Protection

DOI : 10.1016/j.cropro.2007.08.004

Year : 2008

Volume : 27

Issue : 3

First Page : 514

Last Page : 522

Authors : Wang HuaiYin, Yang Yang, Su JianYa, Shen JinLiang, Gao CongFen, Zhu YuCheng.

Reference

Journal : Crop Protection

DOI : 10.1016/j.cropro.2007.08.004

Year : 2008

Volume : 27

Issue : 3

First Page : 514

Last Page : 522

Authors : Wang HuaiYin, Yang Yang, Su JianYa, Shen JinLiang, Gao CongFen, Zhu YuCheng.

Reference

Journal : Crop Protection

Title : Susceptibility of adult Trichogramma nubilale (Hymenoptera: Trichogrammatidae) to selected insecticides with different modes of action

DOI : 10.1016/j.cropro.2011.12.007

Year : 2012

Volume : 34

First Page : 76

Last Page : 72

Authors : Wang Y, Yu R, Zhao X, Chen L, Wu C, Cang T, Wang Q.

Abstract : The parasitic wasp Trichogramma nubilale (Hymenoptera: Trichogrammatidae) is one of the most suitable parasitoids for controlling Asian corn borer, Ostrinia furnacalis (Lepidoptera: Crambidae). Although extensive toxicological tests have been carried out to elucidate the toxicities of insecticides to trichogrammatids, the acute toxicity risks of commonly used insecticides to T. nubilale are not well known. Among the 7 classes of tested chemicals, organophosphates and carbamates had the highest intrinsic toxicity to the parasitoid with LC50 values ranging from 0.081 (0.062–0.12) to 2.10 (1.23–3.47) and from 0.12 (0.11–0.14) to 0.95 (0.87–1.05) mg a.i. per liter, respectively. The phenylpyrazoles (with the exception of butene-fipronil), avermectins, neonicotinoids and pyrethroids induced intermediate toxicity responses with LC50 values ranging from 0.29 to 4.67, 2.36 to 11.27, 1.86 to 311.9, and 10.98–150.3 mg a.i. per liter, respectively. In contrast, insect growth regulators (IGRs) exhibited the least toxicity to the parasitoid with LC50 values ranging from 3452 (3114–3877) to 10,168 (8848–12,027) mg a.i. per liter. A risk quotient analysis indicated that neonicotinoids, avermectins, pyrethroids, IGRs and phenylpyrazoles (with the exception of butene-fipronil) were safe, but organophosphates and carbamates were slightly to moderately toxic or highly toxic to T. nubilale. This study provided informative data for implementing both biological and chemical control strategies in integrated pest management (IPM) of corn lepidopterans.

Reference

Journal : Crop Protection

Title : Susceptibility of adult Trichogramma nubilale (Hymenoptera: Trichogrammatidae) to selected insecticides with different modes of action

DOI : 10.1016/j.cropro.2011.12.007

Year : 2012

Volume : 34

First Page : 76

Last Page : 72

Authors : Wang Y, Yu R, Zhao X, Chen L, Wu C, Cang T, Wang Q.

Assay Description	Organism	Bioactivity
Residual toxicity against compound treated rice leaves-fed adult Anagrus nilaparvatae assessed as mortality measured on day 3 post insecticide treatment to plant	Anagrus	None
Acute oral toxicity against female adult Anagrus nilaparvatae in petridish under laboratory conditions assessed as mortality compound treated as emulsible concentrate with acetone and Triton X-100 measured after 4 hr	Anagrus	None
Acute contact toxicity against adult Anagrus nilaparvatae assessed as dead parasitoid wasps compound treated for 1 hr measured after 8 hr wash-out period	Anagrus	1.07 mgAi/L
Risk quotient, recommended field rate (g/ha) to LC50 for Trichogramma nubilale (mg/L)	Trichogramma nubilale	5000.0
Contact toxicity against Trichogramma nubilale assessed as mortality after 24 hr by modified slight dry film method	Trichogramma nubilale	0.95 mgAi/L	Contact toxicity against Trichogramma nubilale assessed as mortality after 24 hr by modified slight dry film method	Trichogramma nubilale	0.12 mgAi/L

Cross References

Resources	Reference
ChEMBL	CHEMBL2251586
FDA SRS	714I55QH9K
PubChem	17517
SureChEMBL	SCHEMBL64155
ZINC	ZINC00400176

CONTENTS

Structure
Chemical and Physical Properties