cas号： 3030-80-6 ，名称： 2-巯基苯并咪唑锌盐的性质/作用/用途-化学加百科

2-巯基苯并咪唑锌盐

2-巯基苯并咪唑锌盐基本信息
CAS号	3030-80-6	分子式	C7H6N2S.1/2Zn
分子量	365.80303	精确质量	363.97949
PSA	107.96000	LogP	4.23610

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基本信息物化性质毒性结构与计算数据

基本信息展开↓

CAS号：: 3030-80-6
分子式：: C7H6N2S.1/2Zn
分子量：: 365.80303
中文名称：: 2-巯基苯并咪唑锌盐
英文名称：: 2H-Benzimidazole-2-thione, 1,3-dihydro-, zinc salt (2:1)
中文别名：: 2-巯基苯并咪唑锌盐;
促进剂MZ2;
2-硫醇基苯并咪唑锌盐
英文别名：: 2H-Benzimidazole-2-thione, 1,3-dihydro-, zinc salt (2:1);
2-Benzimidazolethiol, zinc salt (2:1) (8CI);
Zinc, bis(2-benzimidazolethiolato)- (6CI,7CI);
1,3-Dihydro-2H-benzimidazole-2-thione zinc salt (2:1);
2-Mercaptobenzimidazole zinc salt;
2-Mercaptobenzimidazole zinc salt (2:1);
Antage MBZ;
Antioxidant MBZ;
Antioxidant ZMB;
Antioxidant ZMBI;
Benzimidazolethiol zinc salt;
Nocrac MBZ;
Vulkanox ZMB;
ZMB;
ZMBI;
Zinc 2-mercaptobenzimidazole;
Zinc benzimidazole-2-thiolate;
Zinc bis(1H-benzimidazole-2-thiolate);
Zinc bis(benzimidazole-2-thiolate);
Zinc mercaptobenzimidazole;
Zinc, bis(1H-benzimidazole-2-thiolato)-
精确分子量/精确质量：: 363.97949
极性分子表面积/PSA：: 107.96000
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：: 221-203-2
InChI：: InChI=1/2C7H6N2S.Zn/c2*10-7-8-5-3-1-2-4-6(5)9-7;/h2*1-4H,(H2,8,9,10);/q;;+2/p-2/rC14H10N4S2Zn/c1-2-6-10-9(5-1)15-13(16-10)19-21-20-14-17-11-7-3-4-8-12(11)18-14/h1-8H,(H,15,16)(H,17,18)

物化性质展开↓

密度：: 1.39 g/cm3
熔点：: 240ºC
沸点：: 270.6ºC at 760 mmHg
闪点：: 117.5ºC

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DE1115000

CHEMICAL NAME :: 2-Benzimidazolethiol, zinc salt

CAS REGISTRY NUMBER :: 3030-80-6

LAST UPDATED :: 199701

DATA ITEMS CITED :: 4

MOLECULAR FORMULA :: C14-H10-N4-S2.Zn

MOLECULAR WEIGHT :: 363.77

WISWESSER LINE NOTATION :: T56 BM DNJ CS 2 &-ZN-

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 :: 540 mg/kg

TOXIC EFFECTS :: Behavioral - somnolence (general depressed activity)

REFERENCE :: HYSAAV Hygiene and Sanitation (USSR). English translation of GISAAA. (Springfield, VA) 1964-71. Discontinued. Volume(issue)/page/year: 31(1-3),183,1966

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 860 mg/kg

TOXIC EFFECTS :: Behavioral - somnolence (general depressed activity)

REFERENCE :: HYSAAV Hygiene and Sanitation (USSR). English translation of GISAAA. (Springfield, VA) 1964-71. Discontinued. Volume(issue)/page/year: 31(1-3),183,1966 ** OTHER MULTIPLE DOSE TOXICITY DATA **

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 3240 mg/kg/30D-I

TOXIC EFFECTS :: Liver - liver function tests impaired Related to Chronic Data - death

REFERENCE :: GISAAA Gigiena i Sanitariya. For English translation, see HYSAAV. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1- 1936- Volume(issue)/page/year: 31(2),25,1966

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:2

3.氢键受体数量:1

4.可旋转化学键数量:0

5.互变异构体数量:2

6.拓扑分子极性表面积:56.2

7.重原子数量:11

8.表面电荷:2

9.复杂度:142

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:2