杀螨醚

杀螨醚 基本信息
CAS号 555-89-5 分子式 C13H10Cl2O2
分子量 269.12300 精确质量  268.00600
PSA  18.46000 LogP  4.40870

基本信息 展开↓

CAS号:
555-89-5
3D弹球模型:
立即前往扯扯看
分子式:
C13H10Cl2O2
分子量:
269.12300
中文名称:
杀螨醚
英文名称:
1-chloro-4-[(4-chlorophenoxy)methoxy]benzene
中文别名:
杀螨醚;
二-(4-氯苯氧基)甲烷
英文别名:
1-chloro-4-[(4-chlorophenoxy)methoxy]benzene;
DCPM;
Di-p-chlorodiphenoxymethane;
Oxythane;
Caswell No. 091;
NEOTRAN
精确分子量/精确质量:
268.00600
极性分子表面积/PSA:
18.46000
油水分配系数/LogP:

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值,反映了物质在油水两相中的分配情况。其中、LogP值越大,说明该物质越亲油;反之,LogP值越小,则说明该物质越亲水。
EINECS:
209-107-9
InChI:
The Key: COVKSLBAQCJQMS-UHFFFAOYSA-N

物化性质展开↓

密度:
1.308 g/cm3
熔点:
70.5℃
沸点:
393.2ºC at 760 mmHg
闪点:
151.5ºC
折射率:
1.585
存储条件/存储方法:
库房通风低温干燥,与食品原料分开储运

合成路线查看所有的合成路线

  • 75-09-2

    二氯甲烷

  • +

  • 106-48-9

    4-氯苯酚

  • ~99%

  • 555-89-5

    杀螨醚

  • 75-09-2

    二氯甲烷

  • +

  • 1193-00-6

    对氯苯酚钠盐二水

  • ~90%

  • 555-89-5

    杀螨醚

  • 75-11-6

    二碘甲烷

  • +

  • 1193-00-6

    对氯苯酚钠盐二水

  • 555-89-5

    杀螨醚

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
PA3890000
CHEMICAL NAME :
Methane, bis(p-chlorophenoxy)-
CAS REGISTRY NUMBER :
555-89-5
BEILSTEIN REFERENCE NO. :
1978248
LAST UPDATED :
199709
DATA ITEMS CITED :
6
MOLECULAR FORMULA :
C13-H10-Cl2-O2
MOLECULAR WEIGHT :
269.13
WISWESSER LINE NOTATION :
GR DO1OR DG

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 :
5800 mg/kg
TOXIC EFFECTS :
Liver - other changes
REFERENCE :
AIHOAX Archives of Industrial Hygiene and Occupational Medicine. (Chicago, IL) V.1-2(3), 1950. For publisher information, see AEHLAU. Volume(issue)/page/year: 1,341,1950
TYPE OF TEST :
LCLo - Lowest published lethal concentration
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
18000 ppm
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
85KYAH "Merck Index; an Encyclopedia of Chemicals, Drugs, and Biologicals", 11th ed., Rahway, NJ 07065, Merck & Co., Inc. 1989 Volume(issue)/page/year: 11,194,1989
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
5800 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FMCHA2 Farm Chemicals Handbook. (Meister Pub., 37841 Euclid Ave., Willoughy, OH 44094) Volume(issue)/page/year: -,C217,1991
TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 4,231,1952
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
>1 mg/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 ** OTHER MULTIPLE DOSE TOXICITY DATA **
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
29400 mg/kg/49D-C
TOXIC EFFECTS :
Liver - other changes Related to Chronic Data - death
REFERENCE :
AIHOAX Archives of Industrial Hygiene and Occupational Medicine. (Chicago, IL) V.1-2(3), 1950. For publisher information, see AEHLAU. Volume(issue)/page/year: 1,341,1950

分子结构与计算化学数据展开↓

计算化学数据


1.疏水参数计算参考值(XlogP):4.9

2.氢键供体数量:0

3.氢键受体数量:2

4.可旋转化学键数量:4

5.互变异构体数量:无

6.拓扑分子极性表面积:18.5

7.重原子数量:17

8.表面电荷:0

9.复杂度:188

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

上下游相关产品

上游产品

更多
  • 75-09-2

    二氯甲烷

  • 106-48-9

    4-氯苯酚

  • 1193-00-6

    对氯苯酚钠盐二水

  • 21151-56-4

    Alpha,4-二氯茴香醚

  • 75-11-6

    二碘甲烷

下游产品

更多
  • 34265-75-3

    1-chloro-4-[chloro-(4-chlorophenoxy)methoxy]benzene

立即下载安装“化学加”APP
专业、功能强大,随时调用更加方便