Benzenesulfonyl Chloride 苯磺酰氯

CAS 98-09-9 MFCD00007426

化学结构图

98-09-9
SMILES: O=S(=O)(Cl)C1CCCCC1

化学属性

Mol. FormulaC6H5ClO2S
Mol. Weight177
Density1.384
Refractive index1.5510 to 1.5530
Boiling Point251-252
Vapor Pressure0.04 mmHg ( 20 °C)
Melting Point13-15
Flash Point132°C(lit.)
TSCAYes
SolubilitySoluble in alcohol, diethyl ether, ether, and benzene. Insoluble in cold water.
Stability易吸潮

别名和识别编码

Chemical NameBenzenesulfonyl Chloride
MDL NumberMFCD00007426
CAS Number98-09-9
Synonym AKOS BBS-00004356 BENZENE SULFOCHLORIDE BENZENE SULFONE CHLORIDE BENZENESULPHONYL CHLORIDE Benzene sulfonyl chloride Benzenesulfochloride Benzenesulfonic(acid)chloride Benzenosulfochloride Benzenosulphochloride Benzensulfonylchlorid Benzolsulfochlorid Benzolsulfonsäurechlorid Benzolsulfonylchlorid Phenylsulfonyl chloride b benzenesulfonyl benzenesulfonyl chloride benzenosulfochlorek(polish) benzolsulfochloride 氟磺苯,氟人经苯磺酰,氯化苯磺酰 氯化苯磺酰 氯化苯磺酰;氯磺苯 氯化苯磺醯基 苯磺酰氯 苯磺酰氯 BENZENESULFONYL CHLORIDE 苯磺酰氯化物,98% 苯磺醯氯
EC Number202-636-6
Beilstein Registry Number606926
PubChem Substance ID87563249
Merck Number1072
Reaxys-RN606926
Chemical Name Translation苯磺酰氯
Wiswesser Line NotationWSGR
LabNetwork Molecule IDLN00195183
InChIInChI=1S/C6H5ClO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H
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分类

  • {SNA} A-B, Puriss p.a., Analytical Reagents for General Use, Puriss p.a., 分析/色谱, 分析试剂
  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; 1fragment
  • {SNA} Building Blocks, Chemical Synthesis, Derivatization Reagents, Derivatization Reagents HPLC, Organic Building Blocks, Sulfonyl Halides, Sulfur Compounds, UV-VIS, 分析/色谱, 分析试剂
  • {SA} Analytical Reagents, Analytical/Chromatography, Building Blocks, Chemical Synthesis, Derivatization Reagents, Derivatization Reagents HPLC, Organic Building Blocks, Sulfonyl Halides, Sulfur Compounds, UV-VIS
  • {Chemicalbook} 农药

产品应用

  • 农药;染料;医药的中间体。用于冰染染料色基的制造,如红色基B;红色基GL。用于磺胺药物的制造。苯磺酰氯是检定胶类的试剂。

相关文献及参考

  • Short: II/25D
  • Merck: 14,1072 Beilstein: 11,IV,49
  • Alternatively, MgBr2 induces a ring-opening reaction leading to ß-unsaturated acids. See, e.g.: Synth. Commun., 19, 2243 (1989).
  • Short: II/14a
  • Merck: 14,1072
  • Reacts with ß-hydroxy esters in pyridine to give ß-lactones which, at higher temperatures eliminate CO2 in a stereospecific alkene synthesis: J. Am. Chem. Soc., 94, 2000 (1972); J. Org. Chem., 39, 1322, 1650 (1974):
  • Short: II/24B

安全信息

GHS Symbol
WGK Germany1
Hazard statements
  • H290 May be corrosive to metals 可能腐蚀金属。
  • H314 Causes severe skin burns and eye damage 导致严重的皮肤灼伤和眼睛损伤
  • H317 May cause an allergic skin reaction 可能导致皮肤过敏
  • H302+H332
  • H334 May cause allergy or asthma symptoms or breathing difficulties if inhaled 吸入可能导致过敏或哮喘症状或呼吸困难
  • H332 Harmful if inhaled 吸入有害
  • H302 Harmful if swallowed 吞食有害
Personal Protective Equipment Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
RTECSDB8750000
Precautionary statements
  • P234 Keep only in original container. 只保留在原来的容器中。
  • P260 Do not breathe dust/fume/gas/mist/vapours/spray. 不要吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西,喝水或吸烟。
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
  • P301+P330+P331+P310
  • P303+P361+P353
  • P303+P361+P353+P310+P363
  • P304+P340
  • P304+P340+P310
  • P305+P351+P338
  • P305+P351+P338+P310
  • P310 Immediately call a POISON CENTER or doctor/physician. 立即呼救解毒中心或医生/医师。
  • P390 Absorb spillage to prevent material damage. 吸收溢出物,防止重大损害。
  • P405 Store locked up. 上锁保管。
  • P406 Store in corrosive resistant/… container with a resistant inner liner. 存放在耐腐蚀/具有耐性的内衬容器。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Danger
Packing GroupIII
UN Number 2225 UN 2225 8/PG 3
Risk Statements
  • R20/22 Harmful by inhalation and if swallowed 吸入和不慎吞咽有害
  • R34 Causes burns 会导致灼伤
  • R42/43
Safety Statements
  • S23 Do not breathe gas/fumes/vapour/spray (appropriate wording to be specified by the manufacturer) 不要吸入气体/烟雾/蒸汽/喷雾;
  • S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后,立即用大量水冲洗并征求医生意见;
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护;
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时,立即求医(可能时出示标签);
Storage condition Moisture Sensitive 易吸潮,密封保存。 储存温度2-8℃,充氩保存
Hazard Codes 8 C
Hazard Class8
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : 828 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   GISAAA Gigiena i Sanitariya.  For English translation, see HYSAAV.  (V/O
   Mezhdunarodnaya Kniga, 113095 Moscow, USSR)  V.1-    1936-
   Volume(issue)/page/year: 36(6),19,1971

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 76 mg/kg
TOXIC EFFECTS :
   Behavioral - somnolence (general depressed activity)
   Lungs, Thorax, or Respiration - respiratory depression
REFERENCE :
   MEPAAX Medycyna Pracy.  Industrial Medicine.  (Ars-Polona, POB 1001, 00-068
   Warsaw 1, Poland) V.1-    1950-  Volume(issue)/page/year: 20,513,1969

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 1960 mg/kg
TOXIC EFFECTS :
   Behavioral - somnolence (general depressed activity)
   Lungs, Thorax, or Respiration - respiratory depression
REFERENCE :
   MEPAAX Medycyna Pracy.  Industrial Medicine.  (Ars-Polona, POB 1001, 00-068
   Warsaw 1, Poland) V.1-    1950-  Volume(issue)/page/year: 20,513,1969

TYPE OF TEST            : LCLo - Lowest published lethal concentration
ROUTE OF E

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 828 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   GISAAA Gigiena i Sanitariya.  For English translation, see HYSAAV.  (V/O
   Mezhdunarodnaya Kniga, 113095 Moscow, USSR)  V.1-    1936-
   Volume(issue)/page/

Warnings 危险化学品

其他信息

  • 用途一:用于制磺胺药物等,也用于鉴定各种胺
  • 可燃性危险特性:可燃; 遇水分解有毒氯化物气体; 燃烧产生有毒氯化物和硫氧化物烟雾
  • 毒性分级:中毒
  • 灭火剂:砂土、干石粉、二氧化碳
  • 下游产品:4-甲苯磺酰氯 --> 4-硝基-2-甲苯胺 --> 4-甲基-2-硝基苯胺 --> 苯硫酚 --> (三氟甲基)三甲基硅烷 --> 亮丙瑞林 --> 颜料紫 23 --> 苯亚磺酸钠 --> 苯磺酰胺 --> 磺胺喹恶啉 --> 2,5-二氯吡啶 --> 2-(2-氯乙氧基)苯磺酰胺 --> 苯硫代磺酸钠 --> 柳氮磺吡啶 --> 克瘟散 --> N,N-二甲基,对十八烷基苯磺酰胺丙基铵基丙磺酸盐 --> 1-(苯磺酰)-1H-吲哚-2-甲醛 --> 2,4-二氯-5-磺酰胺基苯甲酸 --> 酸性黄79 --> 冰染重氮组分 34 --> 2-甲基-3-硝基苯胺 --> 苯磺酰肼 --> 双苯磺酰亚胺
  • MSDS 信息:苯磺酰氯(98-09-9).msds
  • 用途三:苯磺酰氯是一种有机合成原料,在农药上用于合成沙蚕毒类杀虫剂杀虫磺的中间体硫代苯磺酸钠,另外也是医药和染料的中间体。
  • 苯磺酰氯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/08/23 80015128 苯磺酰氯;氯化苯磺酰;氯磺苯 500ml 34.4元 2011/04/16 B0036 苯磺酰氯 Benzenesulfonyl Chloride 25G 165元 2011/04/16 B0036 苯磺酰氯 Benzenesulfonyl Chloride 500G 355元
  • 对湿敏感。不溶于水,易溶于乙醇,溶于乙醚。有腐蚀性。
  • Benzenesulfonyl chloride is prepared by reaction of benzene and chlorosulfonic acid or from the sodium salt of benzenesulfonic acid and PCl5 or POCl3. It reacts with Grignard reagent from N-unsubstituted indoles to form oxindoles or substituted indoles. Benzenesulfonyl chloride is the derivatization reagent for the determination of various amines in waste water and surface water at the sub-ppb level by gas chromatography-mass spectrometry.
  • 储运特性:库房通风低温干燥; 与氧化剂、H发孔剂、碱类、氰化物分开存放
  • Alfa Aesar:苯磺酰氯化物,98% Benzenesulfonyl chloride, 98%(98-09-9)
  • 爆炸物危险特性:在密封瓶中可爆炸;与二甲基亚砜反应爆炸; 与甲基甲酰胺反应激烈
  • 用途二
  • 类别:腐蚀物品
  • 职业标准:STEL 1 毫克/ 立方米
  • 上游原料:苯 --> 氯磺酸
  • MOL 文件:98-09-9.mol
  • Sigma Aldrich:98-09-9(sigmaaldrich)
  • 图谱信息:苯磺酰氯(98-09-9)核磁图( 1 HNMR) 苯磺酰氯(98-09-9)红外图谱(IR1) 苯磺酰氯(98-09-9)质谱(MS) 苯磺酰氯(98-09-9)核磁图( 13 CNMR)
  • 蒸气压:0.04 mm Hg ( 20 °C)
  • F:21
  • 急性毒性:口服- 大鼠 LD50: 1960 毫克/ 公斤; 口服- 小鼠 LD50: 828 毫克/ 公斤
  • Acros Organics:苯磺酰氯 Benzenesulfonyl chloride, 96%(98-09-9)

系列性分类


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