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1086-02-8

1086-02-8结构式

常用中文名：啶菌腈
常用英文名：pyridinitril
CAS号：1086-02-8
分子式：C₁₃H₅Cl₂N₃
分子量：274.10500
发布时间：2018-02-23 08:00:00
更新时间：2024-01-09 08:19:12

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中文名	啶菌腈
英文名	pyridinitril
英文别名	Culvan 2,6-dichloro-4-phenyl-3,5-pyridinedicarbonitrile EINECS 214-119-2 Pyridinitril 2,6-Dichlor-3,5-dicyano-4-phenylpyridin Caswell No. 323G Pyridinitrile IT-3296 DDPP 2,6-dichloro-4-phenylpyridine-3,5-dicarbonitrile

密度	1.48g/cm3
沸点	447.3ºC at 760 mmHg
分子式	C₁₃H₅Cl₂N₃
分子量	274.10500
闪点	224.3ºC
精确质量	272.98600
PSA	60.47000
LogP	3.79876
蒸汽压	3.4E-08mmHg at 25°C
折射率	1.657
储存条件	库房通风低温干燥; 与食品原料分开储运
稳定性	燃烧产生有毒氯化物和氮氧化物气体
分子结构	1、摩尔折射率：68.04 2、摩尔体积（cm³/mol）：184.8 3、等张比容（90.2K）：542.5 4、表面张力（dyne/cm）：74.1 5、极化率（10^-24cm³）：26.97
计算化学	1.疏水参数计算参考值（XlogP）:3.8 2.氢键供体数量:0 3.氢键受体数量:3 4.可旋转化学键数量:1 5.互变异构体数量:无 6.拓扑分子极性表面积60.5 7.重原子数量:18 8.表面电荷:0 9.复杂度:360 10.同位素原子数量:0 11.确定原子立构中心数量:0 12.不确定原子立构中心数量:0 13.确定化学键立构中心数量:0 14.不确定化学键立构中心数量:0 15.共价键单元数量:1

毒理学数据:

口服- 大鼠 LD50: 5000 毫克/ 公斤

CHEMICAL IDENTIFICATION

RTECS NUMBER :: US7960000

CHEMICAL NAME :: 3,5-Pyridinedicarbonitrile, 2,6-dichloro-4-phenyl-

CAS REGISTRY NUMBER :: 1086-02-8

LAST UPDATED :: 199612

DATA ITEMS CITED :: 3

MOLECULAR FORMULA :: C13-H5-Cl2-N3

MOLECULAR WEIGHT :: 274.11

WISWESSER LINE NOTATION :: T6NJ BG CCN DR& ECN FG

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: >5 gm/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: WRPCA2 World Review of Pest Control. (London, UK) V.1-10, 1962-71. Discontinued. Volume(issue)/page/year: 9,119,1970

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Mammal - dog

DOSE/DURATION :: >6400 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: 85JFAN "Agrochemicals Handbook," with updates, Hartley, D., and H. Kidd, eds., Nottingham, Royal Soc. of Chemistry, 1983-86 Volume(issue)/page/year: A359,1983

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Unreported

SPECIES OBSERVED :: Mammal - species unspecified

DOSE/DURATION :: 5 gm/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: 30ZDA9 "Chemistry of Pesticides," Melnikov, N.N., New York, Springer-Verlag New York, Inc., 1971 Volume(issue)/page/year: -,405,1971

海关编码	2933399052

96583-92-5结构式

96583-92-5

~67%

1086-02-8结构式

1086-02-8

文献：Chioua, Mourad; Samadi, Abdelouahid; Soriano, Elena; Lozach, Olivier; Meijer, Laurent; Marco-Contelles, Jose Bioorganic and Medicinal Chemistry Letters, 2009 , vol. 19, # 16 p. 4566 - 4569

67720-42-7结构式

67720-42-7

~%

1086-02-8结构式

1086-02-8

文献：Peinador, Carlos; Veiga, M. Carmen; Vilar, Juan; Quintela, Jose M. Heterocycles, 1994 , vol. 38, # 6 p. 1299 - 1306

上游产品 2
96583-92-5 67720-42-7
下游产品 0

海关编码	2933399052
中文概述	2933399052 啶菌噁唑,苯锈啶,啶斑肟等〔包括啶菌腈〕。监管条件:S(进出口农药登记证明)。增值税率:17.0%。退税率:9.0%。最低关税:6.5%。普通关税:20.0%
Summary	2933399052 (z)-1-(2,4-dichlorophenyl)-2-(pyridin-3-yl)ethanone o-methyl oxime。supervision conditions:s(import or export registration certificate for pesticides)。VAT:17.0%。tax rebate rate:9.0%。MFN tarrif:6.5%。general tariff:20.0%