4403-36-5

• 常用中文名：2-苯二甲酰亚氨基乙烷磺酰氯
• 常用英文名：2-PHTHALIMIDOETHANESULFONYL CHLORIDE
• CAS号：4403-36-5
• 分子式：C₁₀H₈ClNO₄S
• 分子量：273.69300
• 发布时间：2019-01-01 13:29:50
• 更新时间：2024-01-07 15:43:51
• 下载msds

名称

• 中文名: 2-苯二(甲)酰亚氨基乙烷磺酰氯
• 英文名: 2-phthalimidoethanesulfonyl chloride
• 中文别名: 2-苯二甲酰亚氨基乙烷磺酰氯; 2-苯二酰亚氨基乙磺酰氯
• 英文别名: 2-(Phthalimido)ethanesulfonyl chloride; MFCD01861217; 2-Phthalimidoethanesulfonyl chloride; 2-(1,3-dioxoisoindol-2-yl)ethanesulfonyl chloride; 2-(1,3-Dioxoisoindolin-2-yl)ethanesulfonylchloride

物化性质

• 密度: 1.585g/cm3
• 沸点: 416.5ºC at 760mmHg
• 熔点: 158-163ºC
• 分子式: C₁₀H₈ClNO₄S
• 分子量: 273.69300
• 闪点: 205.7ºC
• 精确质量: 272.98600
• PSA: 79.90000
• LogP: 1.86990
• 外观性状: 固体;White to Light yellow powder to crystal
• 折射率: 1.624
• 储存条件: 2-8°C
• 分子结构:

  1、 摩尔折射率：60.99

  2、 摩尔体积（m³/mol）：172.5

  3、 等张比容（90.2K）：487.8

  4、 表面张力（dyne/cm）：63.8

  5、 极化率（10 ^-24cm ³）：24.17

• 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:3

  5.互变异构体数量:无

  6.拓扑分子极性表面积79.9

  7.重原子数量:17

  8.表面电荷:0

  9.复杂度:418

  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

• 更多:

  1. 性状：白色粉末

  2. 密度（g/mL ,25℃）：不确定

  3. 相对蒸汽密度（g/mL,空气=1）：不确定

  4. 熔点（ºC）：156-160

  5. 沸点（ºC）：不确定

  6. 沸点（ºC,13mmHg）：不确定

  7. 折射率：不确定

  8. 闪点（ºF）：不确定

  9. 比旋光度（º）：不确定

  10. 自燃点或引燃温度（ºC）：不确定

  11. 蒸汽压（20ºC）：不确定

  12. 饱和蒸气压（kPa,60ºC）：不确定

  13. 燃烧热（KJ/mol）：不确定

  14. 临界温度（ºC）：不确定

  15. 临界压力（KPa）：不确定

  16. 油水（辛醇/水）分配系数的对数值：不确定

  17. 爆炸上限（%,V/V）：不确定

  18. 爆炸下限（%,V/V）：不确定

  19. 溶解性：不确定

MSDS

SECTION 1: Identification of the substance/mixture and of the company/undertaking Product identifiers Product name: 2-Phthalimidoethanesulfonyl chloride REACH No.: A registration number is not available for this substance as the substance or its uses are exempted from registration, the annual tonnage does not require a registration or the registration is envisaged for a later registration deadline. CAS-No.: 4403-36-5 Relevant identified uses of the substance or mixture and uses advised against Identified uses: Laboratory chemicals, Manufacture of substances SECTION 2: Hazards identification Classification of the substance or mixture Classification according to Regulation (EC) No 1272/2008 Skin corrosion (Category 1B), H314 For the full text of the H-Statements mentioned in this Section, see Section 16. Classification according to EU Directives 67/548/EEC or 1999/45/EC C CorrosiveR34 For the full text of the R-phrases mentioned in this Section, see Section 16. Label elements Labelling according Regulation (EC) No 1272/2008 Pictogram Signal wordDanger Hazard statement(s) H314Causes severe skin burns and eye damage. Precautionary statement(s) P280Wear protective gloves/ protective clothing/ eye protection/ face protection. P305 + P351 + P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing. P310Immediately call a POISON CENTER or doctor/ physician. Supplemental Hazard information (EU) EUH014Reacts violently with water. Other hazards - none SECTION 3: Composition/information on ingredients Substances Formula: C10H8ClNO4S Molecular Weight: 273,69 g/mol CAS-No.: 4403-36-5 Hazardous ingredients according to Regulation (EC) No 1272/2008 ComponentClassificationConcentration 2-Phthalimidoethanesulfonyl chloride CAS-No.4403-36-5Skin Corr. 1B; , H314,<= 100 % EUH014 For the full text of the H-Statements and R-Phrases mentioned in this Section, see Section 16 SECTION 4: First aid measures Description of first aid measures General advice Consult a physician. Show this safety data sheet to the doctor in attendance. If inhaled If breathed in, move person into fresh air. If not breathing, give artificial respiration. Consult a physician. In case of skin contact Take off contaminated clothing and shoes immediately. Wash off with soap and plenty of water. Consult a physician. In case of eye contact Rinse thoroughly with plenty of water for at least 15 minutes and consult a physician. If swallowed Do NOT induce vomiting. Never give anything by mouth to an unconscious person. Rinse mouth with water. Consult a physician. Most important symptoms and effects, both acute and delayed The most important known symptoms and effects are described in the labelling (see section 2.2) and/or in section 11 Indication of any immediate medical attention and special treatment needed no data available SECTION 5: Firefighting measures Extinguishing media Suitable extinguishing media Dry powder Special hazards arising from the substance or mixture no data available Advice for firefighters Wear self contained breathing apparatus for fire fighting if necessary. Further information no data available SECTION 6: Accidental release measures Personal precautions, protective equipment and emergency procedures Use personal protective equipment. Avoid dust formation. Avoid breathing vapours, mist or gas. Ensure adequate ventilation. Evacuate personnel to safe areas. Avoid breathing dust. For personal protection see section 8. Environmental precautions Do not let product enter drains. Methods and materials for containment and cleaning up Pick up and arrange disposal without creating dust. Sweep up and shovel. Do not flush with water. Keep in suitable, closed containers for disposal. Reference to other sections For disposal see section 13. SECTION 7: Handling and storage Precautions for safe handling Avoid formation of dust and aerosols. Provide appropriate exhaust ventilation at places where dust is formed. For precautions see section 2.2. Conditions for safe storage, including any incompatibilities Store in cool place. Keep container tightly closed in a dry and well-ventilated place. Never allow product to get in contact with water during storage. Recommended storage temperature: 2 - 8 °C Handle and store under inert gas. Moisture sensitive. Specific end use(s) A part from the uses mentioned in section 1.2 no other specific uses are stipulated SECTION 8: Exposure controls/personal protection Control parameters Components with workplace control parameters Exposure controls Appropriate engineering controls Handle in accordance with good industrial hygiene and safety practice. Wash hands before breaks and at the end of workday. Personal protective equipment Eye/face protection Face shield and safety glasses Use equipment for eye protection tested and approved under appropriate government standards such as NIOSH (US) or EN 166(EU). Skin protection Handle with gloves. Gloves must be inspected prior to use. Use proper glove removal technique (without touching glove's outer surface) to avoid skin contact with this product. Dispose of contaminated gloves after use in accordance with applicable laws and good laboratory practices. Wash and dry hands. The selected protective gloves have to satisfy the specifications of EU Directive 89/686/EEC and the standard EN 374 derived from it. Body Protection Complete suit protecting against chemicals, Flame retardant protective clothing, The type of protective equipment must be selected according to the concentration and amount of the dangerous substance at the specific workplace. Respiratory protection Where risk assessment shows air-purifying respirators are appropriate use a full-face particle respirator type N100 (US) or type P3 (EN 143) respirator cartridges as a backup to engineering controls. If the respirator is the sole means of protection, use a full-face supplied air respirator. Use respirators and components tested and approved under appropriate government standards such as NIOSH (US) or CEN (EU). Control of environmental exposure Do not let product enter drains. SECTION 9: Physical and chemical properties Information on basic physical and chemical properties a) AppearanceForm: solid Colour: white, off-white b) Odourno data available c) Odour Thresholdno data available d) pHno data available e) Melting point/freezingno data available point f) Initial boiling point and no data available boiling range g) Flash pointno data available h) Evapouration rateno data available i) Flammability (solid, gas) no data available j) Upper/lowerno data available flammability or explosive limits k) Vapour pressureno data available l) Vapour densityno data available m) Relative densityno data available n) Water solubilityno data available o) Partition coefficient: n- no data available octanol/water p) Auto-ignitionno data available temperature q) Decompositionno data available temperature r) Viscosityno data available s) Explosive propertiesno data available t) Oxidizing propertiesno data available Other safety information no data available SECTION 10: Stability and reactivity Reactivity no data available Chemical stability Stable under recommended storage conditions. Possibility of hazardous reactions Reacts violently with water. Conditions to avoid Exposure to moisture. Incompatible materials Strong oxidizing agents Hazardous decomposition products Other decomposition products - no data available In the event of fire: see section 5 SECTION 11: Toxicological information Information on toxicological effects Acute toxicity no data available Skin corrosion/irritation no data available Serious eye damage/eye irritation no data available Respiratory or skin sensitisation no data available Germ cell mutagenicity no data available Carcinogenicity IARC:No component of this product present at levels greater than or equal to 0.1% is identified as probable, possible or confirmed human carcinogen by IARC. Reproductive toxicity no data available Specific target organ toxicity - single exposure no data available Specific target organ toxicity - repeated exposure no data available Aspiration hazard no data available Additional Information RTECS: Not available burning sensation, Cough, wheezing, laryngitis, Shortness of breath, spasm, inflammation and edema of the larynx, spasm, inflammation and edema of the bronchi, pneumonitis, pulmonary edema, Material is extremely destructive to tissue of the mucous membranes and upper respiratory tract, eyes, and skin. SECTION 12: Ecological information Toxicity no data available Persistence and degradability no data available Bioaccumulative potential no data available Mobility in soil no data available Results of PBT and vPvB assessment PBT/vPvB assessment not available as chemical safety assessment not required/not conducted Other adverse effects no data available SECTION 13: Disposal considerations Waste treatment methods Product Offer surplus and non-recyclable solutions to a licensed disposal company. Dissolve or mix the material with a combustible solvent and burn in a chemical incinerator equipped with an afterburner and scrubber. Contaminated packaging Dispose of as unused product. SECTION 14: Transport information UN number ADR/RID: 3261IMDG: 3261IATA: 3261 UN proper shipping name ADR/RID: CORROSIVE SOLID, ACIDIC, ORGANIC, N.O.S. (2-Phthalimidoethanesulfonyl chloride) IMDG: CORROSIVE SOLID, ACIDIC, ORGANIC, N.O.S. (2-Phthalimidoethanesulfonyl chloride) IATA:Corrosive solid, acidic, organic, n.o.s. (2-Phthalimidoethanesulfonyl chloride) Transport hazard class(es) ADR/RID: 8IMDG: 8IATA: 8 Packaging group ADR/RID: IIIMDG: IIIATA: II Environmental hazards ADR/RID: noIMDG Marine pollutant: noIATA: no Special precautions for user no data available SECTION 15: Regulatory information This safety datasheet complies with the requirements of Regulation (EC) No. 1907/2006. Safety, health and environmental regulations/legislation specific for the substance or mixture no data available Chemical Safety Assessment For this product a chemical safety assessment was not carried out SECTION 16: Other information Full text of H-Statements referred to under sections 2 and 3. EUH014Reacts violently with water. H314Causes severe skin burns and eye damage. Skin Corr.Skin corrosion Full text of R-phrases referred to under sections 2 and 3 R34 Causes burns. Further information Copyright 2013 Co. LLC. License granted to make unlimited paper copies for internal use only. The above information is believed to be correct but does not purport to be all inclusive and shall be used only as a guide. The information in this document is based on the present state of our knowledge and is applicable to the product with regard to appropriate safety precautions. It does not represent any guarantee of the properties of the product. Corporation and its Affiliates shall not be held liable for any damage resulting from handling or from contact with the above product. See and/or the reverse side of invoice or packing slip for additional terms and conditions of sale.

毒性和生态

毒理学数据: 主要的刺激性影响 在皮肤上面：在皮肤和粘膜上造成腐蚀性影响 在眼睛上面：强烈腐蚀性影响 过敏作用：没有已知的敏化影响

安全

• 符号: GHS05
• 信号词: Danger
• 危害声明: H314
• 补充危害声明: Reacts violently with water.
• 警示性声明: P280-P305 + P351 + P338-P310
• 危害码 (欧洲): Xi,C
• 风险声明 (欧洲): R34
• 安全声明 (欧洲): S26-S36/37/39
• 危险品运输编码: 3261
• 包装等级: II
• 危险类别: 8
• 海关编码: 2925190090

合成路线

85-44-9 107-35-7 ~33% 4403-36-5

文献：Pfizer INC Patent: US6313312 B1, 2001 ;

4443-24-7 ~87% 4403-36-5

文献：Shin, Kye Jung; Yoo, Kyung Ho; Kim, Dong Jin; Park, Sang Woo; Ko, Bong Suck; Lee, Sang Joo; Huh, Jae Doo; Park, Seung Yong Bioorganic and Medicinal Chemistry Letters, 1998 , vol. 8, # 13 p. 1607 - 1612

110475-43-9 ~86% 4403-36-5

文献：Humljan, Jan; Gobec, Stanislav Tetrahedron Letters, 2005 , vol. 46, # 23 p. 4069 - 4072 Title/Abstract Full Text View citing articles Show Details Humljan, Jan; Kotnik, Miha; Boniface, Audrey; Solmajer, Tomaz; Urleb, Uros; Blanot, Didier; Gobec, Stanislav Tetrahedron, 2006 , vol. 62, # 47 p. 10980 - 10988

52208-11-4 ~% 4403-36-5

文献：Yang, Zhanhui; Xu, Jiaxi Synthesis (Germany), 2013 , vol. 45, # 12 art. no. SS-2013-H0216-OP, p. 1675 - 1682

85-44-9 ~% 4403-36-5

文献：Yudakhina; Moreva; Zarubin; Purygin Russian Journal of Organic Chemistry, 2013 , vol. 49, # 6 p. 934 - 935 Zh. Org. Khim., 2013 , vol. 49, # 6 p. 947 - 948,2

上下游产品

上游产品  5
85-44-9 107-35-7 4443-24-7 110475-43-9
52208-11-4
下游产品  3
300-84-5 81428-04-8 4443-23-6

海关

海关编码	2925190090
中文概述	2925190090 其他酰亚胺及其衍生物盐. 增值税率:17.0% 退税率:9.0% 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	2925190090 other imides and their derivatives; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%