3-(Aminosulfonyl)-4-chlorobenzoic Acid 4-氯-3-磺酰胺基苯甲酸

CAS 1205-30-7 MFCD00012375

化学结构图

1205-30-7
SMILES: NS(=O)(=O)c1cc(C(=O)O)ccc1Cl

化学属性

Mol. FormulaC7H6ClNO4S
Mol. Weight235.64
Melting Point256-258°C
TSCANo
Density1.649
Boiling Point502.4±60.0 °C at 760 mmHg

别名和识别编码

Chemical Name3-(Aminosulfonyl)-4-chlorobenzoic Acid
CAS Number1205-30-7
Synonym 4-Chloro-3-sulfamoylbenzoic acid {LY} 4-Chloro-3-sulfamoylbenzoic acid {} {LY} 4-Chloro-3-sulfamoylbenzoic acid {} {} {LY} 4-Chloro-3-sulfamoylbenzoic acid {} {} {} {LY} 4-Chloro-3-sulfamoylbenzoic acid {} {} {} {} {LY} 4-Chloro-3-sulfamoylbenzoic acid {} {} {} {} {} {LY} 4-Chloro-3-sulfamoylbenzoic acid {} {} {} {} {} {} {LY} 4-Chloro-3-sulfamoylbenzoic acid {} {} {} {} {} {} {} {LY} 4-Chloro-3-sulfamoylbenzoic acid {} {} {} {} {} {} {} {} {LY} 4-Chloro-3-sulfamoylbenzoic acid {} {} {} {} {} {} {} {} {} {LY} 4-Chloro-3-sulfamoylbenzoic acid {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloro-3-sulfamoylbenzoic acid {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloro-3-sulfamoylbenzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloro-3-sulfamoylbenzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloro-3-sulfamoylbenzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloro-3-sulfamoylbenzoic acid {} {} {} {} {} {
MDL NumberMFCD00012375
EC Number214-882-1
PubChem Substance ID14568
Reaxys-RN2118346
Chemical Name Translation4-氯-3-磺酰胺基苯甲酸
InChIKeyFHQAWINGVCDTTG-UHFFFAOYSA-N
Beilstein Registry Number2118346
LabNetwork Molecule IDLN00227159
InChIInChI=1S/C7H6ClNO4S/c8-5-2-1-4(7(10)11)3-6(5)14(9,12)13/h1-3H,(H,10,11)(H2,9,12,13)
Canonical SMILESO=C(O)C1=CC=C(Cl)C(S(=O)(N)=O)=C1
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分类

  • Sulfur & Selenium Compounds
  • Aromatics
  • Amines
  • {SNA} Building Blocks, Chemical Synthesis, Organic Building Blocks, Sulfonamides/Sulfinamides, Sulfur Compounds

安全信息

Safety Statements
  • S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/面保护;
  • 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;
  • S37 Wear suitable gloves 戴适当手套;
Risk Statements
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
Hazard Codes Xi
WGK Germany3
GHS Symbol
Precautionary statements
  • 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。
  • P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
  • 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。
  • P302+P350
  • P302+P352
  • P302+P352+P332+P313+P362+P364
  • P304+P340
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适,呼叫解毒中心或医生/医师。
  • P321 Specific treatment (see … on this label). 具体治疗(见本标签上的)。
  • P332+P313
  • P337+P313
  • P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服,清洗后方可重新使用
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Warning
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
RTECSDG5642600
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : >2 gm/kg
TOXIC EFFECTS :
   Behavioral - tremor
   Behavioral - ataxia
   Lungs, Thorax, or Respiration - respiratory depression
REFERENCE :
   KSRNAM Kiso to Rinsho.  Clinical Report.  (Yubunsha Co., Ltd., 1-5, Kanda
   Suda-Cho, Chiyoda-ku, KS Bldg., Tokyo 101, Japan)  V.1-    1960-
   Volume(issue)/page/year: 16,2275,1982

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 1100 mg/kg
TOXIC EFFECTS :
   Behavioral - tremor
   Behavioral - ataxia
   Lungs, Thorax, or Respiration - respiratory depression
REFERENCE :
   KSRNAM Kiso to Rinsho.  Clinical Report.  (Yubunsha Co., Ltd., 1-5, Kanda
   Suda-Cho, Chiyoda-ku, KS Bldg., Tokyo 101, Japan)  V.1-    1960-
   Volume(issue)/page/year: 16,2275,1982

Storage condition Store at room temperature {LY} Store at room temperature {} {LY} Store at room temperature {} {} {LY} Store at room temperature {} {} {} {LY} Store at room temperature {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

其他信息

  • TCI Shanghai:4-氯-3-磺酰胺苯甲酸 4-Chloro-3-sulfamoylbenzoic Acid,>;95.0%(T)(1205-30-7)
  • MOL 文件:1205-30-7.mol
  • 用途二:医药合成。
  • 4-氯-3-磺酰胺基苯甲酸价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 A1189 4-氯-3-磺酰胺苯甲酸 4-Chloro-3-sulfamoylbenzoic Acid 500G 1520元 2014/06/02 A1189 4-氯-3-磺酰胺苯甲酸 4-Chloro-3-sulfamoylbenzoic Acid 25G 216元 2010/05/25 B24057 4-氯-3-磺酰胺基苯甲酸, 98% 4-Chloro-3-sulfamoylbenzoic acid, 98% 250g 1140元
  • Sigma Aldrich:1205-30-7(sigmaaldrich)
  • 用途一:用于药物布美他尼的合成
  • 图谱信息:4-氯-3-磺酰胺基苯甲酸(1205-30-7)核磁图( 1 HNMR) 4-氯-3-磺酰胺基苯甲酸(1205-30-7)核磁图( 13 CNMR) 4-氯-3-磺酰胺基苯甲酸(1205-30-7)质谱(MS) 4-氯-3-磺酰胺基苯甲酸(1205-30-7)红外图谱(IR1) 4-氯-3-磺酰胺基苯甲酸(1205-30-7)红外图谱(IR2)
  • Alfa Aesar:4-氯-3-磺酰胺基苯甲酸,98% 4-Chloro-3-sulfamoylbenzoic acid, 98%(1205-30-7)

系列性分类


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