苄索氯铵

外观与性状：

白色结晶粉末

密度：

0.998 g/mL at 20 °C

熔点：

162-164 °C(lit.)

水溶解性：

1-5 g/100 mL at 18 ºC

存储条件/存储方法：

通风低温干燥,与库房食品原料分开存放

稳定性相关：

一、基本性质

  无色六方片状结晶。味极苦。对光和空气敏感。极易溶于水，成泡沫液体，溶于乙醇、丙酮和氯仿。其1%水溶液的pH为4.8～5.5。在120℃微熔。熔点164～166℃。有刺激性。

 

其它信息：

1.          性状：无色六方片状结晶

2.         熔点（℃）：164-166

3.         PH值（1%水溶液）：4.8-5.5

4.          水溶性（g/100mL,18 ºC）：1-5

包装等级：

III

风险类别：

8

海关代码：

2942000000

WGK_Germany：

2
德国有关水污染物质的分类清单

危险类别码：

R22;R36

安全说明：

S26-S36/39-S24/25

RTECS号：

BO7175000

安全标志：

S26:万一接触眼睛，立即使用大量清水冲洗并送医诊治。
S45:出现意外或者感到不适，立刻到医生那里寻求帮助（最好带去产品容器标签）。
:

危险标志：

Xn:Harmful

CHEMICAL IDENTIFICATION

RTECS NUMBER :

BO7175000

CHEMICAL NAME :

Ammonium, benzyldimethyl(2-(2-(p-(1,1,3,3-tetramethylbutyl)phen oxy)ethoxy)ethyl)-, chloride

CAS REGISTRY NUMBER :

121-54-0

LAST UPDATED :

199710

DATA ITEMS CITED :

26

MOLECULAR FORMULA :

C27-H42-N-O2.Cl

MOLECULAR WEIGHT :

448.15

WISWESSER LINE NOTATION :

1X1&1&1X1&1&R DO2O2K1&1&1R &Q &G

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :

Standard Draize test

ROUTE OF EXPOSURE :

Administration into the eye

SPECIES OBSERVED :

Rodent - rabbit

TYPE OF TEST :

LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :

Oral

SPECIES OBSERVED :

Rodent - rat

DOSE/DURATION :

368 mg/kg

TOXIC EFFECTS :

Details of toxic effects not reported other than lethal dose value

TYPE OF TEST :

LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :

Intraperitoneal

SPECIES OBSERVED :

Rodent - rat

DOSE/DURATION :

16500 ug/kg

TOXIC EFFECTS :

Behavioral - altered sleep time (including change in righting reflex) Behavioral - convulsions or effect on seizure threshold Lungs, Thorax, or Respiration - respiratory depression

TYPE OF TEST :

LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :

Subcutaneous

SPECIES OBSERVED :

Rodent - rat

DOSE/DURATION :

119 mg/kg

TOXIC EFFECTS :

Details of toxic effects not reported other than lethal dose value

TYPE OF TEST :

LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :

Intravenous

SPECIES OBSERVED :

Rodent - rat

DOSE/DURATION :

19 mg/kg

TOXIC EFFECTS :

Behavioral - somnolence (general depressed activity) Kidney, Ureter, Bladder - hematuria Blood - changes in cell count (unspecified)

TYPE OF TEST :

LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :

Unreported

SPECIES OBSERVED :

Rodent - rat

DOSE/DURATION :

420 mg/kg

TOXIC EFFECTS :

Details of toxic effects not reported other than lethal dose value

TYPE OF TEST :

LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :

Oral

SPECIES OBSERVED :

Rodent - mouse

DOSE/DURATION :

338 mg/kg

TOXIC EFFECTS :

Details of toxic effects not reported other than lethal dose value

TYPE OF TEST :

LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :

Intraperitoneal

SPECIES OBSERVED :

Rodent - mouse

DOSE/DURATION :

7813 ug/kg

TOXIC EFFECTS :

Details of toxic effects not reported other than lethal dose value

TYPE OF TEST :

LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :

Intravenous

SPECIES OBSERVED :

Rodent - mouse

DOSE/DURATION :

30 mg/kg

TOXIC EFFECTS :

Details of toxic effects not reported other than lethal dose value

TYPE OF TEST :

TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :

Oral

SPECIES OBSERVED :

Rodent - rat

DOSE/DURATION :

182 gm/kg/2Y-C

TOXIC EFFECTS :

Gastrointestinal - other changes Nutritional and Gross Metabolic - weight loss or decreased weight gain Related to Chronic Data - death

TYPE OF TEST :

TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :

Administration onto the skin

SPECIES OBSERVED :

Rodent - rat

DOSE/DURATION :

60 mg/kg/16D-I

TOXIC EFFECTS :

Endocrine - changes in thymus weight Skin and Appendages - dermatitis, other (after systemic exposure) Nutritional and Gross Metabolic - weight loss or decreased weight gain

TYPE OF TEST :

TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :

Administration onto the skin

SPECIES OBSERVED :

Rodent - rat

DOSE/DURATION :

203 mg/kg/13W-I

TOXIC EFFECTS :

Skin and Appendages - dermatitis, other (after systemic exposure)

TYPE OF TEST :

TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :

Subcutaneous

SPECIES OBSERVED :

Rodent - rat

DOSE/DURATION :

312 mg/kg/1Y-I

TOXIC EFFECTS :

Nutritional and Gross Metabolic - weight loss or decreased weight gain

TYPE OF TEST :

TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :

Administration onto the skin

SPECIES OBSERVED :

Rodent - mouse

DOSE/DURATION :

1200 mg/kg/16D-I

TOXIC EFFECTS :

Cardiac - changes in heart weight Endocrine - changes in thymus weight Skin and Appendages - dermatitis, other (after systemic exposure)

TYPE OF TEST :

TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :

Administration onto the skin

SPECIES OBSERVED :

Rodent - mouse

DOSE/DURATION :

101 mg/kg/13W-I

TOXIC EFFECTS :

Skin and Appendages - dermatitis, other (after systemic exposure)

TYPE OF TEST :

TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :

Subcutaneous

SPECIES OBSERVED :

Rodent - rat

DOSE/DURATION :

104 mg/kg/1Y-I

TOXIC EFFECTS :

Tumorigenic - neoplastic by RTECS criteria Skin and Appendages - tumors Tumorigenic - tumors at site of application

MUTATION DATA

TYPE OF TEST :

Sister chromatid exchange

TEST SYSTEM :

Rodent - hamster Embryo

DOSE/DURATION :

1 mg/L

REFERENCE :

SHIGAZ Shigaku. Ondotology. (Nippon Shika Daigaku Shigakkai, 1-9-20 Fujimi, Chiyodaku, Tokyo 102, Japan) V.38- 1949- Volume(issue)/page/year: 74,1365,1987 *** REVIEWS *** TOXICOLOGY REVIEW JACTDZ Journal of the American College of Toxicology. (Mary Ann Liebert, Inc., 1651 Third Ave., New York, NY 10128) V.1-12, 1982-1993. Discontinued. Volume(issue)/page/year: 4(5),65,1985 *** U.S. STANDARDS AND REGULATIONS *** EPA FIFRA 1988 PESTICIDE SUBJECT TO REGISTRATION OR RE-REGISTRATION FEREAC Federal Register. (U.S. Government Printing Office, Supt. of Documents, Washington, DC 20402) V.1- 1936- Volume(issue)/page/year: 54,7740,1989 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - 25830 No. of Facilities: 2975 (estimated) No. of Industries: 15 No. of Occupations: 26 No. of Employees: 26546 (estimated) NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - 25830 No. of Facilities: 1657 (estimated) No. of Industries: 11 No. of Occupations: 20 No. of Employees: 26949 (estimated) No. of Female Employees: 18054 (estimated)

毒理学数据：

急性毒性：

口腔 LD50         338mg/kg(mus)

         368mg/kg(rbt)

刺激眼睛 severe    30ug(rbt)

主要的刺激性影响：

在皮肤上面：在皮肤和黏膜上造成腐蚀性影响。

刺激皮肤和黏膜

在眼睛上面：强烈飞腐蚀性影响

刺激的影响

致敏作用：没有已知的敏化影响。

生态数据：

总括注解

水危害级别3（德国规例）（通过名单进行自我评估）该物质对水有稍微危害的。

 即使是小量不要让该产品接触地下水、水道或污水系统。 

即使是极其小量的产品渗入地下也会对饮用水造成危险。

对水中的鱼和浮游生物有毒害

若无政府许可，勿将材料排入周围环境。

对水中的有机物有剧毒。

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:3

4.可旋转化学键数量:12

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:31

8.表面电荷:0

9.复杂度:466

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

• 
  苄索氯铵红外图谱(IR1)
• 
  苄索氯铵红外图谱(IR2)
• 
  苄索氯铵质谱(MS)