溴酚磷酸一水合物

  • 基本信息
  • 制备方法及用途
  • 物化性质
  • 安全信息
  • 毒理性
  • 海关数据
  • 结构与计算化学

溴酚磷酸一水合物 基本信息

中文名称:
溴酚磷酸一水合物 
中文别名:
溴酚磷酸一水合物;
溴酚磷酯 
英文名称:
[1,1'-Biphenyl]-2,2'-diol,3,3',5,5'-tetrabromo-, 2-(dihydrogen phosphate)
英文别名:
[2,4-dibromo-6-(3,5-dibromo-2-hydroxyphenyl)phenyl] dihydrogen phosphate;
Acedist;
EINECS 244-400-5;
Bromfenofos;
bromofenofos;
Ph 1882;
2-Hydroxy-3.3'.5.5'-tetrabrom-biphenylyl-(2')-dihydrogenphosphat;
Bromfenphos;
Bromofenofosum [INN-Latin] 
CAS No.:
21466-07-9
分 子 式:
C12H7Br4O5P
分 子 量:
599.79
精确分子量:
595.68700
PSA:
106.03000
EINECS:
244-400-5
InChI:
The Key: MMYHZEDBTMXYAF-UHFFFAOYSA-N
分子结构式:
SDS:
查看

溴酚磷酸一水合物 制备方法及用途

合成制备方法


用途


溴酚磷酸一水合物 物化性质

密度:
2.379g/cm3
沸点:
562.8ºC at 760 mmHg
闪点:
294.2ºC
折射率:
1.709
蒸汽压:
1.67E-13mmHg at 25°C
存储条件/存储方法:
库房通风低温干燥,与食品原料分开存放
稳定性相关:


其它信息:

1. 性状:未确定

2. 密度(g/mL,25/4):未确定

3. 相对蒸汽密度(g/mL,空气=1未确定

4. 熔点(ºC):未确定

5. 沸点(ºC,常压):未确定

6. 沸点(ºC,5.2kPa): 未确定

7. 折射率: 未确定

8. 闪点(ºC): 未确定

9. 比旋光度(º): 未确定

10. 自燃点或引燃温度(ºC): 未确定

11. 蒸气压(kPa,25ºC): 未确定

12. 饱和蒸气压(kPa,60ºC): 未确定

13. 燃烧热(KJ/mol):未确定

14. 临界温度(ºC): 未确定

15. 临界压力(KPa): 未确定

16. 油水(辛醇/水)分配系数的对数值: 未确定

17. 爆炸上限(%,V/V):未确定

18. 爆炸下限(%,V/V): 未确定

19. 溶解性:未确定

溴酚磷酸一水合物 安全信息

海关代码:
2922299090

溴酚磷酸一水合物 毒理性

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DV5190000
CHEMICAL NAME :
2,2'-Biphenyldiol, 3,3',5,5'-tetrabromo-, mono(dihydrogen phosphate)
CAS REGISTRY NUMBER :
21466-07-9
LAST UPDATED :
199707
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C12-H7-Br4-O5-P
MOLECULAR WEIGHT :
581.80

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Mammal - domestic
DOSE/DURATION :
50 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FAZMAE Fortschritte der Arzneimittelforschung. Progress in Drug Research. (Birkhauser Boston, Inc., c/o Springer-Verlag New York, 44 Hartz Way, Secaucus, NJ 07094) V.1- 1959- Volume(issue)/page/year: 17,108,1973 ** REPRODUCTIVE DATA **
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
50 mg/kg
SEX/DURATION :
female 9 day(s) after conception
TOXIC EFFECTS :
Reproductive - Fertility - post-implantation mortality (e.g. dead and/or resorbed implants per total number of implants) Reproductive - Fertility - litter size (e.g. # fetuses per litter; measured before birth) Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death, e.g., stunted fetus)
REFERENCE :
ARTODN Archives of Toxicology. (Springer-Verlag, Heidelberger Pl. 3, D-1000 Berlin 33, Fed. Rep. Ger.) V.32- 1974- Volume(issue)/page/year: 60,319,1987
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
50 mg/kg
SEX/DURATION :
female 8 day(s) after conception
TOXIC EFFECTS :
Reproductive - Specific Developmental Abnormalities - musculoskeletal system Reproductive - Specific Developmental Abnormalities - other developmental abnormalities
REFERENCE :
TJADAB Teratology, The International Journal of Abnormal Development. (Alan R. Liss, Inc., 41 E. 11th St., New York, NY 10003) V.1- 1968- Volume(issue)/page/year: 36,464,1987
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
20 mg/kg
SEX/DURATION :
female 8-15 day(s) after conception
TOXIC EFFECTS :
Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death, e.g., stunted fetus)
REFERENCE :
TOLED5 Toxicology Letters. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1977- Volume(issue)/page/year: 31,243,1986
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
50 mg/kg
SEX/DURATION :
female 8 day(s) after conception
TOXIC EFFECTS :
Reproductive - Specific Developmental Abnormalities - craniofacial (including nose and tongue) Reproductive - Specific Developmental Abnormalities - musculoskeletal system Reproductive - Specific Developmental Abnormalities - urogenital system
REFERENCE :
ARTODN Archives of Toxicology. (Springer-Verlag, Heidelberger Pl. 3, D-1000 Berlin 33, Fed. Rep. Ger.) V.32- 1974- Volume(issue)/page/year: 60,319,1987
毒理学数据:

急性毒性:小鼠口经LD50:50 mg/kg

生态数据:


溴酚磷酸一水合物 海关数据

中国海关编码:2922299090

概述:
2922299090. 其他氨基(萘酚、酚)及醚、酯〔包括它们的盐, 但含有一种以上含氧基的除外〕. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:30.0%
申报要素:
品名, 成分含量, 用途, 乙醇胺及其盐应报明色度, 乙醇胺及其盐应报明包装
摘要/Summary:
2922299090. other amino-naphthols and other amino-phenols, other than those containing more than one kind of oxygen function, their ethers and esters; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

溴酚磷酸一水合物 分子结构与计算化学数据

分子结构数据


计算化学数据

1.疏水参数计算参考值(XlogP):4.3

2.氢键供体数量:3

3.氢键受体数量:5

4.可旋转化学键数量:3

5.互变异构体数量:3

6.拓扑分子极性表面积87

7.重原子数量:22

8.表面电荷:0

9.复杂度:436

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

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产品介绍:
产品名称:溴酚磷酯 Cas号:21466-07-9 纯度:97% 包装信息:200mg 价格:1,030.0元
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