2-[(4-Chlorophenyl)Sulfonyl]Acetic Acid 2-[(4-氯苯基)磺酰基]乙酸

CAS 3405-89-8 MFCD00201948

化学结构图

3405-89-8
SMILES: O=C(O)CS(=O)(=O)c1ccc(Cl)cc1

化学属性

Mol. FormulaC8H7ClO4S
Mol. Weight235
Melting Pointca 140° dec.
TSCANo

别名和识别编码

Chemical Name2-[(4-Chlorophenyl)sulfonyl]acetic acid
CAS Number3405-89-8
Alfabeta NameCHLOROPHENYLSULFONYLACETICACID 24[]()--
MDL NumberMFCD00201948
Synonym (4-CHLORO-BENZENESULFONYL)-ACETIC ACID (4-CHLOROBENZENESULPHONYL)ACETIC ACID (4-Chlorobenzenesulfonyl)acetic acid (4-氯苯磺酰基)乙酸 2-[(4-CHLOROPHENYL)SULFONYL]ACETIC ACID 2-[(4-Chlorophenyl)sulfony]Acetic Acid 2-[(4-chlorophenyl)sulfonyl]acetic acid 2-[(4-氯苯基)磺酰基]乙酸 4-CHLOROPHENYLSULFONYLACETIC ACID 4-CHLOROPHENYLSULFONYLACETIC ACID ---WHITE POWDER--- AKOS BBS-00002849 IFLAB-BB F0722-0258 RARECHEM AL BO 0476 TIMTEC-BB SBB008563 acetic acid, [(4-chlorophenyl)sulfonyl]-
Chemical Name Translation2-[(4-氯苯基)磺酰基]乙酸
PubChem Substance ID55680
LabNetwork Molecule IDLN00125481
InChIInChI=1S/C8H7ClO4S/c9-6-1-3-7(4-2-6)14(12,13)5-8(10)11/h1-4H,5H2,(H,10,11)
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分类

  • {KO} CarboxylicAcids
  • {SNA} Building Blocks, Chemical Synthesis, Organic Building Blocks, Sulfones, Sulfur Compounds

安全信息

Warnings IRRITANT
Safety Statements
  • 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
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
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。
  • P264+P265
  • 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+P352
  • P304+P340
  • P305+P351+P338
  • 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。
  • P319
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • P332+P313
  • P332+P317
  • P337+P313
  • P337+P317
  • 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
  • P362+P364
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 5
Y
H-bond Acceptors
4
Rotatable Bonds
3
H-bond Donors
1
LogP
1

其他信息

  • 2-[(4-氯苯基)磺酰基]乙酸价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2010/05/25 H27414 (4-氯苯磺酰基)乙酸, 98% (4-Chlorophenylsulfonyl)acetic acid, 98% 500mg 3458元 2010/05/25 H27414 (4-氯苯磺酰基)乙酸, 98% (4-Chlorophenylsulfonyl)acetic acid, 98% 100mg 1121元
  • Alfa Aesar:(4-氯苯磺酰基)乙酸,98% (4-Chlorophenylsulfonyl)acetic acid, 98%(3405-89-8)
  • MOL 文件:3405-89-8.mol

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Sulfur Compounds 硫化合物
  5. Sulfones - Sulfur Compounds

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