3-Rhodanineacetic Acid 3-羧甲基绕丹宁

CAS 5718-83-2 MFCD00005491

化学结构图

5718-83-2
SMILES: O=C(O)CN1C(=O)CSC1=S

化学属性

Mol. FormulaC5H5NO3S2
Mol. Weight191.2281
Density1.422
Melting Point145-148 °C
TSCAYes
Boiling Point375.4±44.0 °C at 760 mmHg

别名和识别编码

Chemical Name3-Rhodanineacetic Acid
MDL NumberMFCD00005491
CAS Number5718-83-2
EC Number227-220-1
Beilstein Registry Number149513
Synonym Rhodanine-N-acetic acid {LY} Rhodanine-N-acetic acid {} {LY} Rhodanine-N-acetic acid {} {} {LY} Rhodanine-N-acetic acid {} {} {} {LY} Rhodanine-N-acetic acid {} {} {} {} {LY} Rhodanine-N-acetic acid {} {} {} {} {} {LY} Rhodanine-N-acetic acid {} {} {} {} {} {} {LY} Rhodanine-N-acetic acid {} {} {} {} {} {} {} {LY} Rhodanine-N-acetic acid {} {} {} {} {} {} {} {} {LY} Rhodanine-N-acetic acid {} {} {} {} {} {} {} {} {} {LY} Rhodanine-N-acetic acid {} {} {} {} {} {} {} {} {} {} {LY} Rhodanine-N-acetic acid {} {} {} {} {} {} {} {} {} {} {} {LY} Rhodanine-N-acetic acid {} {} {} {} {} {} {} {} {} {} {} {} {LY} Rhodanine-N-acetic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Rhodanine-N-acetic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Rhodanine-N-acetic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Rhodanine-N-acetic acid {} {} {} {} {} {} {} {} {} {} {} {} {}
PubChem Substance ID79793
Chemical Name Translation3-羧甲基绕丹宁
Reaxys-RN149513
InChIKeyJGRMXPSUZIYDRR-UHFFFAOYSA-N
LabNetwork Molecule IDLN00225992
InChIInChI=1S/C5H5NO3S2/c7-3-2-11-5(10)6(3)1-4(8)9/h1-2H2,(H,8,9)
Canonical SMILESS=C(SC1)N(CC(O)=O)C1=O
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分类

  • {SNA} Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks, Thiazolines/Thiazolidines

安全信息

Signal word Warning
GHS Symbol
WGK Germany3
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；
  • S36 Wear suitable protective clothing 穿戴适当的防护服；
  • 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；
  • 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
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。
  • P281 Use personal protective equipment as required. 使用所需的个人防护装备。
  • 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。
  • 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.....
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
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes Xi
Storage condition 2-8°C, stored under nitrogen {LY} 2-8°C, stored under nitrogen {} {LY} 2-8°C, stored under nitrogen {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitro

其他信息

  • 用途一:用作药物依帕司他中间体
  • Alfa Aesar:罗丹宁-3-乙酸,98% Rhodanine-3-acetic acid, 98%(5718-83-2)
  • 3-羧甲基绕丹宁价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 R0054 绕丹宁-3-乙酸 Rhodanine-3-acetic Acid 25G 651元 2010/05/25 B22244 罗丹宁-3-乙酸, 98% Rhodanine-3-acetic acid, 98% 5g 272元 2010/05/25 B22244 罗丹宁-3-乙酸, 98% Rhodanine-3-acetic acid, 98% 25g 672元
  • 下游产品:依帕斯他
  • 海关编码:29341000
  • F:10-23
  • Sigma Aldrich:5718-83-2(sigmaaldrich)
  • 上游原料:乙醇 --> 氢氧化钠 --> 盐酸 --> 四氢呋喃 --> N,N-二甲基甲酰胺 --> 乙腈 --> 溴乙酸乙酯 --> 三甲基氯硅烷 --> 硫氰酸铵 --> 巯基乙酸甲酯 --> 硫氰酸钾 --> 四丁基氟化铵 --> 溴乙酸
  • 用途二:依帕斯他中间体。
  • MOL 文件:5718-83-2.mol
  • TCI Shanghai:绕丹宁-3-乙酸 Rhodanine-3-acetic Acid,>;98.0%(T)(5718-83-2)
  • MSDS 信息:4-Oxo-2-thioxo-3-thiazolidinylacetic acid(5718-83-2).msds

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Thiazoles 噻唑
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Thiazolines/Thiazolidines 噻唑啉/噻唑烷
  1. Functional Group 官能团索引
  2. thiocarbamic acid ester

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