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4080-31-3生产厂家

4080-31-3价格

4080-31-3

4080-31-3结构式
4080-31-3结构式

化源商城直购

中文名 1-(3-氯-2-丙烯基)-3,5,7-三氮杂-1-氮翁三环[3,3,1,13,7]癸烷氯化物
英文名 quaternium-15
中文别名 1-(3-氯代烯丙基)-3,5,7-三氮杂-1-氮翁氯化金刚烷
季铵盐-15
英文别名 Dowicil 75
Quaternium 15
Dowicil 100
N-(3-Chloroallyl)hexaminium chloride
Methenamine 3-chloroallylochloride
Dowicide Q
Cinartc 200
Quaternium-15
UNII-2W5B4VJ152
熔点 178-210ºC
分子式 C9H16Cl2N4
分子量 251.15600
精确质量 250.07500
PSA 9.72000
储存条件 库房低温通风干燥,与食品原料分开存放
计算化学

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:4

4.可旋转化学键数量:2

5.互变异构体数量:无

6.拓扑分子极性表面积:9.7

7.重原子数量:15

8.表面电荷:0

9.复杂度:224

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:1

14.不确定化学键立构中心数量:0

15.共价键单元数量:2

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XX8450000
CHEMICAL NAME :
3,5,7-Triaza-1-azoniaadamantane, 1-(3-chloroallyl)-, chloride
CAS REGISTRY NUMBER :
4080-31-3
LAST UPDATED :
199701
DATA ITEMS CITED :
14
MOLECULAR FORMULA :
C9-H16-Cl-N4.Cl
MOLECULAR WEIGHT :
251.19
WISWESSER LINE NOTATION :
T66 B6 A B- C 1B I BK DN FN HNTJ B2U1G &Q &G

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
500 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 - rabbit
DOSE/DURATION :
78500 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 :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
565 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 - guinea pig
DOSE/DURATION :
710 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 :
Bird - chicken
DOSE/DURATION :
2 gm/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 :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
1500 mg/kg/3W-I
TOXIC EFFECTS :
Brain and Coverings - changes in brain weight Related to Chronic Data - changes in testicular weight
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
1500 mg/kg/30D-I
TOXIC EFFECTS :
Liver - other changes
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
250 mg/kg
SEX/DURATION :
female 6-15 day(s) after conception
TOXIC EFFECTS :
Reproductive - Specific Developmental Abnormalities - eye/ear Reproductive - Specific Developmental Abnormalities - other developmental abnormalities

MUTATION DATA

TYPE OF TEST :
Mutation in microorganisms
TEST SYSTEM :
Bacteria - Salmonella typhimurium
DOSE/DURATION :
333 ug/plate
REFERENCE :
EMMUEG Environmental and Molecular Mutagenesis. (Alan R. Liss, Inc., 41 E. 11th St., New York, NY 10003) V.10- 1987- Volume(issue)/page/year: 11(Suppl 12),1,1988 *** 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 - M2880 No. of Facilities: 513 (estimated) No. of Industries: 8 No. of Occupations: 9 No. of Employees: 5887 (estimated) NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - M2880 No. of Facilities: 8643 (estimated) No. of Industries: 67 No. of Occupations: 77 No. of Employees: 137018 (estimated) No. of Female Employees: 38857 (estimated)