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海松碘铵
- 基本信息
- 安全信息
- 毒理性
- 海关数据
- 结构与计算化学
- 上游产品
海松碘铵 基本信息
- 中文名称：
- 海松碘铵
- 中文别名：
- 海松碘铵
- 英文名称：
- Sulfonium,[2-[(2-cyclohexyl-2-phenylacetyl)oxy]ethyl]dimethyl-, iodide (1:1)
- 英文别名：
- 2-(2-cyclohexyl-2-phenylacetyl)oxyethyl-dimethylsulfanium,iodide;
Ioduro de hexasonio [INN-Spanish];
Hexadiphensulfone iodide;
Hexadiphensulfonium iodatum;
[2-(Cyclohexyl-phenyl-acetoxy)-aethyl]-dimethyl-sulfonium,Jodid;
Thiospasmin [Czech];
Iodure d'hexasonium [INN-French];
[2-(cyclohexyl-phenyl-acetoxy)-ethyl]-dimethyl sulfonium,iodide;
Hexasonium iodide;
Thiospasmine;
Hexasonii iodidum [INN-Latin];
(2-((cyclohexylphenylacetyl)oxy)ethyl)dimethylsulfonium iodide;
Thiospasmin
- CAS No.：
- 3569-59-3
- 分 子 式：
- C18H27O2S.I
- 分 子 量：
- 0
- 精确分子量：
- 434.07800
- PSA：
- 51.60000
- InChI：
- The Key: LZXCSAFKUYXBTJ-UHFFFAOYSA-M
- 分子结构式：
-
- SDS：
- 查看
海松碘铵 毒理性
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- WR8050000
- CHEMICAL NAME :
- Sulfonium, (2-hydroxyethyl)dimethyl-, iodide,
alpha-phenylcyclohexaneacetate
- CAS REGISTRY NUMBER :
- 3569-59-3
- LAST UPDATED :
- 199012
- DATA ITEMS CITED :
- 5
- MOLECULAR FORMULA :
- C18-H27-O2-S.I
- MOLECULAR WEIGHT :
- 434.41
- WISWESSER LINE NOTATION :
- L6TJ AYR&VO2S1&1 &Q &I
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 7700 ug/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- PHTXA6 Pharmacology and Toxicology. English translation of FATOAO. (New
York, NY) V.20-22, 1957-59. Discontinued. Volume(issue)/page/year:
20,348,1957
- TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 270 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- PHTXA6 Pharmacology and Toxicology. English translation of FATOAO. (New
York, NY) V.20-22, 1957-59. Discontinued. Volume(issue)/page/year:
20,348,1957
- TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Subcutaneous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 220 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- PHTXA6 Pharmacology and Toxicology. English translation of FATOAO. (New
York, NY) V.20-22, 1957-59. Discontinued. Volume(issue)/page/year:
20,348,1957
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 3200 ug/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- 28ZPAK "Sbornik Vysledku Toxixologickeho Vysetreni Latek A Pripravku,"
Marhold, J.V., Institut Pro Vychovu Vedoucicn Pracovniku Chemickeho Prumyclu
Praha, Czechoslovakia, 1972 Volume(issue)/page/year: -,253,1972
- TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- 5 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- PHTXA6 Pharmacology and Toxicology. English translation of FATOAO. (New
York, NY) V.20-22, 1957-59. Discontinued. Volume(issue)/page/year:
20,348,1957
海松碘铵 海关数据
中国海关编码：2930909090
- 概述：
- 2930909090. 其他有机硫化合物. 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
- 摘要/Summary：
- 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%
海松碘铵 分子结构与计算化学数据
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:7
5.互变异构体数量:无
6.拓扑分子极性表面积:27.3
7.重原子数量:22
8.表面电荷:0
9.复杂度:304
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:1
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
