2,2',4,4',6,6'-六氯联苯

2,2',4,4',6,6'-六氯联苯 基本信息
CAS号 33979-03-2 分子式 C12H4Cl6
分子量 360.87800 精确质量  357.84400
PSA  0.00000 LogP  7.27400

基本信息 展开↓

CAS号:
33979-03-2
3D弹球模型:
立即前往扯扯看
分子式:
C12H4Cl6
分子量:
360.87800
中文名称:
2,2',4,4',6,6'-六氯联苯
英文名称:
2,2',4,4',6,6'-hexachlorobiphenyl
中文别名:
2,2',4,4',6,6'-六氯联苯;
2,2’,4,4’,6,6’-六氯二苯酚
英文别名:
2,2',4,4',6,6'-hexachlorobiphenyl;
2,2',4,4',6,6'-Hcb;
2,2',4,4',6,6'-Hexachloro-1,1'-biphenyl;
2,2',4,4',6,6'-hexachlorodiphenyl;
Biphenyl,2,2',4,4',6,6'-hexachloro;
2,4,6,2',4',6'-Hexachlorobiphenyl;
1,3,5-trichloro-2-(2,4,6-trichlorophenyl)benzene;
EINECS 251-773-8;
2,2',4,4',5,5'-Hexachlorobiphenyl;
1,1'-Biphenyl,2,2',4,4',6,6'-hexachloro;
2,2',4,4',6,6'-HEXACHLOROBIPHENYL
精确分子量/精确质量:
357.84400
极性分子表面积/PSA:
0.00000
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:
251-773-8
InChI:
The Key: ICOAEPDGFWLUTI-UHFFFAOYSA-N

物化性质展开↓

密度:
1.593 g/cm3
熔点:
114ºC
沸点:
365.6ºC at 760 mmHg
闪点:
170.5ºC
折射率:
1.626

安全信息展开↓

海关代码:
2903999090

合成路线查看所有的合成路线

  • 863098-32-2

    1-[4-(2-bromoethynyl)phenyl]ethanone

  • +

  • 73852-18-3

    2,4,6-三氯苯硼酸

  • 33979-03-2

    2,2',4,4',6,6'-六氯联苯

  • +

  • 1315475-95-6

    1-[4-(2,4,6-trichloro-phenylethynyl)phenyl]ethanone

  • 67-56-1

    甲醇

  • +

  • 104891-98-7

    3-Amino-3-(2,4,6-trichlor-phenylazo)propensaeuremethylester

  • 634-90-2

    1,2,3,5-四氯苯

  • +

  • 108-70-3

    1,3,5-三氯苯

  • +

  • 5329-12-4

    2,4,6-三氯苯肼

  • +

  • 33979-03-2

    2,2',4,4',6,6'-六氯联苯

  • +

  • 108-59-8

    丙二酸二甲酯

  • +

  • 634-93-5

    2,4,6-三氯苯胺

  • 25179-49-1

    1,2-bis(3,5-dichlorophenyl)diazene

  • 33979-03-2

    2,2',4,4',6,6'-六氯联苯

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DV5359050
CHEMICAL NAME :
1,1'-Biphenyl, 2,2',4,4',6,6'-hexachloro-
CAS REGISTRY NUMBER :
33979-03-2
BEILSTEIN REFERENCE NO. :
2058693
LAST UPDATED :
199710
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C12-H4-Cl6

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
150 mg/kg/3D-I
TOXIC EFFECTS :
Biochemical - Enzyme inhibition, induction, or change in blood or tissue levels - other esterases Biochemical - Enzyme inhibition, induction, or change in blood or tissue levels - other hydrolases Biochemical - Enzyme inhibition, induction, or change in blood or tissue levels - other Enzymes
REFERENCE :
TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 33,94,1975
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1414 mg/kg/22D-C
TOXIC EFFECTS :
Liver - fatty liver degeneration Endocrine - other changes Related to Chronic Data - death
REFERENCE :
TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 58,461,1981
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Bird - chicken
DOSE/DURATION :
1470 mg/kg/21D-C
TOXIC EFFECTS :
Liver - changes in liver weight Biochemical - Enzyme inhibition, induction, or change in blood or tissue levels - cytochrome oxidases (including oxidative phosphorylation) Biochemical - Enzyme inhibition, induction, or change in blood or tissue levels - transaminases
REFERENCE :
TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 36,81,1976

海关数据查看详细

中国海关编码:2903999090

概述:
2903999090 其他芳烃卤化衍生物. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:5.5% 普通关税:30.0%
申报要素:
品名, 成分含量, 用途
摘要/Summary:
2903999090 halogenated derivatives of aromatic hydrocarbons VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

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):无

2.氢键供体数量:0

3.氢键受体数量:0

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:0

7.重原子数量:18

8.表面电荷:0

9.复杂度:234

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
  • 863098-32-2

    Ethanone, 1-[4-(2-bromoethynyl)phenyl]-

  • 73852-18-3

    2,4,6-三氯苯硼酸

  • 6324-50-1

    1-碘-2,4,6-三氯苯

  • 108-70-3

    1,3,5-三氯苯

  • 634-93-5

    2,4,6-三氯苯胺

下游产品

更多
  • 64560-17-4

    1,3,7,9-tetrachlorodibenzofuran

立即下载安装“化学加”APP
专业、功能强大,随时调用更加方便