에틸2-디메톡시포스피노티오일술파닐-2-페닐-아세테이트

에틸2-디메톡시포스피노티오일술파닐-2-페닐-아세테이트 · D-Papthion · Brn 2474108 · (+)-alpha-((Dimethoxyphosphinothioyl)thio)benzeneacetic acid ethyl ester

https://huagongshe.com/ko/chemical/17435

식별자 및 물리적 특성

CAS No.	2597-03-7
분자식	C12H17O4PS2
평균 분자량	320.4 g/mol
단동위원소 질량	320.03058765 g/mol
SMILES	CCOC(=O)C(SP(=S)(OC)OC)c1ccccc1
InChIKey	XAMUDJHXFNRLCY-UHFFFAOYSA-N
PubChem CID	17435
ChEMBL	CHEMBL1476858
ChEBI	CHEBI:34917
EC No.	219-997-0
DTXSID	DTXSID6042280
현지명	에틸2-디메톡시포스피노티오일술파닐-2-페닐-아세테이트

화학 및 물리적 성질

XLogP	3.7
극성 표면적	102
수소 결합 공여자 수	0
수소 결합 수용자 수	6
회전 가능 결합 수	8
무거운 원자 수	19
형식 전하	0
복잡도	324
농약	PesticidesInsecticidesActive substance -> EU Pesticides database: Not approvedPesticides -> Organophosphate InsecticidesPesticide (Phenthoate) -> USDA PDB
LogP(분배 계수)	Kow = 49003.32
냄새	AROMATIC
밀도	1.226 @ 20 °C/4 °C
Color/Form	COLORLESS, CRYSTALLINE SOLID
용해도	REDDISH-YELLOW OILSOLUBILITY: IN WATER @ 20 °C= 200 MG/L (TECHNICAL GRADE)IN HEXANE @ 20 °C= 120 G/LGREATER THAN 200 G/L IN 1,2-DIMETHOXYETHANE, 20 °C (PURE)IN PETROLEUM SPIRIT @ 20 °C= 100-170 G/L /TECHNICAL/11 MG/L WATER @ 24 °CMiscible in all proportions with methanol, ethanol, benzene, xylene, acetone, cyclohexanone, methylcellosolve, carbon tetrachloride and carbon disulfide, ethyl ether, dioxane, and cyclohexaneSoluble in aromatic hydrocarbons, ketones, alcohols, chloroform, and carbon tetrachloride. Barely soluble in ... petroleum ether.
인화점	165-170 °C
끓는 점	70-80 °C at 2-5X10-5 mm Hg
녹는점	17 TO 18 °C
증기압	0.0000026 [mmHg]2.6X10-6 mm Hg at 25 °C
굴절률	INDEX OF REFRACTION: 1.5550 @ 20 °C/D
Physical Description	Colorless solidmp = 17-18 deg CTechnical product: reddish-yellow liquid[HSDB] Liquid[MSDSonline]

안전 및 규제

GHS 분류	WarningH302: Harmful if swallowed [Warning Acute toxicity, oral]P264, P270, P273, P280, P301+P317, P302+P352, P317, P321, P330, P362+P364, P391, and P501 (click each P-code to see the statement)DangerH302+H312 (90.5%): Harmful if swallowed or in contact with skin [Warning Acute toxicity, oralacute toxicity, dermal]P260, P264, P270, P271, P273, P280, P284, P301+P317, P302+P352, P304+P340, P316, P317, P320, P321, P330, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
규제 정보	2002/2076
유해성 요약	No evidence of mutagenicity[HSDB] In 116 week feeding study with rats cholinesterase activity was depressed, but no significant histopathological findings or increased tumor frequency[Reference #1] The average of two baseline respective cholinesterase activity determinations three days apart, with no exposures to enzyme inhibiting pesticides for at least 30 days, is recommended for each worker prior to exposure to cholinesterase inhibitors because of large inter-individual differences in published baseline values. To be established at least once a year. Removal from workplace exposures is recommended until the cholinesterase activity returns to within 20% of baseline. [TLVs and BEIs]
FIFRA 요건	As the federal pesticide law FIFRA directs, EPA is conducting a comprehensive review of older pesticides to consider their health and environmental effects and make decisions about their future use. Under this pesticide reregistration program, EPA examines health and safety data for pesticide active ingredients initially registered before November 1, 1984, and determines whether they are eligible for reregistration. In addition, all pesticides must meet the new safety standard of the Food Quality Protection Act of 1996. Pesticides for which EPA had not issued Registration Standards prior to the effective date of FIFRA, as amended in 1988, were divided into three lists based upon their potential for human exposure and other factors, with List B containing pesticides of greater concern and List D pesticides of less concern. Ethyl alpha-((dimethoxyphosphinothioyl)thio)benzeneacetate is found on List B. Case No: 2800Pesticide type: insecticideCase Status: No products containing the pesticide are actively registered ... The case /is characterized/ as "cancelled." Under FIFRA, pesticide producers may voluntarily cancel their registered products. EPA also may cancel pesticide registrations if registrants fail to pay required fees or make/meet certain reregistration commitments, or if EPA reaches findings of unreasonable adverse effects.