4338-95-8

• 常用中文名：氨基亚氨基硫代甲基氢碘酸
• 常用英文名：Carbamimidothioic acid,methyl ester, monohydriodide (9CI)
• CAS号：4338-95-8
• 分子式：C₂H₇IN₂S
• 分子量：218.06000
• 发布时间：2018-07-13 13:53:12
• 更新时间：2024-01-03 21:35:56
• 下载msds

名称

• 中文名: 氨基亚氨基硫代甲基氢碘酸
• 英文名: methyl aminomethanimidothioate hydroiodide
• 英文别名: methylthiouroniumiodide; 2-methyl-2-thio-pseudourehydriodide; Methyl carbamimidothioate hydroiodide; s-methylthiuroniumiodide; methyl imidothiocarbamate hydroiodide; S-methylthiouronium iodide; S-methyl imidothiocarbamate hydroiodide; 2-methyl-2-thiopseudourea hydroiodide; s-methylisothiouroniumiodide; 2-methylisothiouroniumiodide; s-methylisothioureahydriodide; S-Methylisothiourea hydroiodide

物化性质

• 密度: 1.26g/cm3
• 沸点: 138.8ºC at 760mmHg
• 熔点: 82ºC
• 分子式: C₂H₇IN₂S
• 分子量: 218.06000
• 闪点: 37.7ºC
• 精确质量: 217.93700
• PSA: 75.17000
• LogP: 2.04110
• 储存条件: 2-8°C，避光，惰性气体保存
• 计算化学:

  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:2

  4.可旋转化学键数量:1

  5.互变异构体数量:无

  6.拓扑分子极性表面积:75.2

  7.重原子数量:6

  8.表面电荷:0

  9.复杂度:42.9

  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

MSDS

Material Safety Data Sheet Section1. Identification of the substance Product Name: Methyl aminomethanimidothioate hydroiodide Synonyms:S-Methylisothiourea hydroiodide Section2. Hazards identification Harmful by inhalation, in contact with skin, and if swallowed. Section3. Composition/information on ingredients. Ingredient name:Methyl aminomethanimidothioate hydroiodide CAS number:4338-95-8 Section4. First aid measures Skin contact:Immediately wash skin with copious amounts of water for at least 15 minutes while removing contaminated clothing and shoes. If irritation persists, seek medical attention. Eye contact:Immediately wash skin with copious amounts of water for at least 15 minutes. Assure adequate flushing of the eyes by separating the eyelids with fingers. If irritation persists, seek medical attention. Inhalation:Remove to fresh air. In severe cases or if symptoms persist, seek medical attention. Ingestion:Wash out mouth with copious amounts of water for at least 15 minutes. Seek medical attention. Section5. Fire fighting measures In the event of a fire involving this material, alone or in combination with other materials, use dry powder or carbon dioxide extinguishers. Protective clothing and self-contained breathing apparatus should be worn. Section6. Accidental release measures Personal precautions: Wear suitable personal protective equipment which performs satisfactorily and meets local/state/national standards. Respiratory precaution:Wear approved mask/respirator Hand precaution:Wear suitable gloves/gauntlets Skin protection:Wear suitable protective clothing Eye protection:Wear suitable eye protection Methods for cleaning up: Mix with sand or similar inert absorbent material, sweep up and keep in a tightly closed container for disposal. See section 12. Environmental precautions: Do not allow material to enter drains or water courses. Section7. Handling and storage Handling:This product should be handled only by, or under the close supervision of, those properly qualified in the handling and use of potentially hazardous chemicals, who should take into account the fire, health and chemical hazard data given on this sheet. Store in closed vessels. Storage: Section8. Exposure Controls / Personal protection Engineering Controls: Use only in a chemical fume hood. Personal protective equipment: Wear laboratory clothing, chemical-resistant gloves and safety goggles. General hydiene measures: Wash thoroughly after handling. Wash contaminated clothing before reuse. Section9. Physical and chemical properties Appearance:Not specified Boiling point:No data No data Melting point: Flash point:No data Density:No data Molecular formula:C2H6N2S.HI Molecular weight:218.1 Section10. Stability and reactivity Conditions to avoid: Heat, flames and sparks. Materials to avoid: Oxidizing agents. Possible hazardous combustion products: Carbon monoxide, nitrogen oxides, hydrogen Iodide, sulfur oxides. Section11. Toxicological information No data. Section12. Ecological information No data. Section13. Disposal consideration Arrange disposal as special waste, by licensed disposal company, in consultation with local waste disposal authority, in accordance with national and regional regulations. Section14. Transportation information Non-harzardous for air and ground transportation. Section15. Regulatory information No chemicals in this material are subject to the reporting requirements of SARA Title III, Section 302, or have known CAS numbers that exceed the threshold reporting levels established by SARA Title III, Section 313. SECTION 16 - ADDITIONAL INFORMATION N/A

毒性和生态

CHEMICAL IDENTIFICATION RTECS NUMBER : UM9000000 CHEMICAL NAME : Pseudourea, 2-methyl-2-thio-, hydriodide CAS REGISTRY NUMBER : 4338-95-8 LAST UPDATED : 199212 DATA ITEMS CITED : 2 MOLECULAR FORMULA : C2-H6-N2-S.H-I MOLECULAR WEIGHT : 218.07 WISWESSER LINE NOTATION : MUYZS1 &IH HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LDLo - Lowest published lethal dose 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 REFERENCE : JAFCAU Journal of Agricultural and Food Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB 57136, West End Stn., Washington, DC 20037) V.1- 1953- Volume(issue)/page/year: 2,1176,1954 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 320 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#00858

安全

• 危害码 (欧洲): Xi
• 海关编码: 2930909090

合成路线

17356-08-0 74-88-4 ~97% 4338-95-8

文献：Aoyagi, Naoto; Furusho, Yoshio; Endo, Takeshi Synlett, 2014 , vol. 25, # 7 art. no. 6650, p. 983 - 986

海关

海关编码	2930909090
中文概述	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
Summary	2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%