Cyclo(aspartyl-phenylalanyl) (2S,5S)-5-苄基-3,6-二氧代-2-哌嗪乙酸

CAS 5262-10-2 MFCD00190764

化学结构图

5262-10-2
SMILES: O=C(O)C[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC1=O

化学属性

Mol. FormulaC13H14N2O4
Mol. Weight262.26
Melting Point270-272 °C(lit.)

别名和识别编码

Chemical Name2-((2S,5S)-5-Benzyl-3,6-Dioxopiperazin-2-Yl)Acetic Acid
MDL NumberMFCD00190764
PubChem Substance ID111054
CAS Number5262-10-2
EC Number226-075-1
Chemical Name Translation(2S,5S)-5-苄基-3,6-二氧代-2-哌嗪乙酸
Synonym (2S,5S)-3,6-Dioxo-5-(phenylmethyl)-2-piperazineacetic acid {LY} (2S,5S)-3,6-Dioxo-5-(phenylmethyl)-2-piperazineacetic acid cyclo(Asp-Phe) cyclo(aspartyl-phenylalanyl) {} {LY} (2S,5S)-3,6-Dioxo-5-(phenylmethyl)-2-piperazineacetic acid {} {} {LY} (2S,5S)-3,6-Dioxo-5-(phenylmethyl)-2-piperazineacetic acid {} {} {} {LY} (2S,5S)-3,6-Dioxo-5-(phenylmethyl)-2-piperazineacetic acid {} {} {} {} {LY} (2S,5S)-3,6-Dioxo-5-(phenylmethyl)-2-piperazineacetic acid {} {} {} {} {} {LY} (2S,5S)-3,6-Dioxo-5-(phenylmethyl)-2-piperazineacetic acid {} {} {} {} {} {} {LY} (2S,5S)-3,6-Dioxo-5-(phenylmethyl)-2-piperazineacetic acid {} {} {} {} {} {} {} {LY} (2S,5S)-3,6-Dioxo-5-(phenylmethyl)-2-piperazineacetic acid {} {} {} {} {} {} {} {} {LY} (2S,5S)-3,6-Dioxo-5-(phenylmethyl)-2-piperazineacetic acid {} {} {} {} {} {} {} {} {} {LY} (2S,5S)-3,6-Dioxo-5-(phenylmethyl)-2-piperazineacetic acid {} {} {} {} {} {} {} {} {} {} {LY} (2S,5S)-3,6-Dioxo-5-(phenylmethyl)-2-piperazine
InChIKeyVNHJXYUDIBQDDX-UWVGGRQHSA-N
LabNetwork Molecule IDLN01283176
InChIInChI=1S/C13H14N2O4/c16-11(17)7-10-13(19)14-9(12(18)15-10)6-8-4-2-1-3-5-8/h1-5,9-10H,6-7H2,(H,14,19)(H,15,18)(H,16,17)/t9-,10-/m0/s1
Canonical SMILESO=C(N[C@H](C(N1)=O)CC(O)=O)[C@@H]1CC2=CC=CC=C2
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分类

  • {SNA} Asymmetric Synthesis,
  • {SNA} Analytical Standards, Food & Beverage Standards, Food and Cosmetic Component Standards, Sweetener Standards, 分析/色谱, 甜味剂
  • {SNA} Analytical Standards, Food & Beverage Standards, Food and Cosmetic Component Standards, 分析/色谱, 甜味剂
  • Asymmetric Synthesis, Chemical Synthesis, Chiral Building Blocks, Heterocyclic Building Blocks, Piperazines
  • {SNA} Alphabetical Index of Analytical Standards, Analytical Standards, Analytical/Chromatography, B, BA - BH, Chromatography, Food & Beverage Standards, 甜味剂
  • {SNA} Alphabetical Index of Analytical Standards, Analytical Standards,

相关文献及参考

  • FT-IR 2 (2), 3063:B / Structure Index 1 , 328:A:4

安全信息

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。
  • 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.....
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
Hazard Codes Xi
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
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；
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
Storage condition 2-8°C {LY} 2-8°C {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {

系列性分类

  1. Chemical Synthesis 化学合成
  2. Asymmetric Synthesis 不对称合成
  3. Chiral Building Blocks 手性分子砌块
  4. Heterocyclic Building Blocks - Chiral Building Blocks
  5. Piperazines - Heterocyclic Building Blocks
  1. Chemical Synthesis 化学合成
  2. Asymmetric Synthesis 不对称合成
  3. Chiral Building Blocks 手性分子砌块
  4. Heterocyclic Building Blocks - Chiral Building Blocks
  5. Piperazines - Heterocyclic Building Blocks

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