1-Cbz-3-oxopiperazine 4-Cbz-2-哌嗪酮

CAS 78818-15-2 MFCD00173924

化学结构图

78818-15-2
SMILES: O=C1CN(CCN1)C(=O)OCC1C=CC=CC=1

化学属性

Mol. FormulaC12H14N2O3
Mol. Weight234.26
Melting Point118-122
TSCANo

别名和识别编码

Chemical Name1-Cbz-3-oxopiperazine
CAS Number78818-15-2
Alfabeta NameBENZYLOXOTETRAHYDROPYRAZINECARBOXYLATE H312()---
MDL NumberMFCD00173924
Synonym 4-苄氧羰基-2-哌嗪酮 3-氧代哌嗪-1-羧酸苄酯 4-Benzyloxycarbonyl-2-piperazinone
PubChem Substance ID253659787
Chemical Name Translation4-Cbz-2-哌嗪酮
LabNetwork Molecule IDLN00003126
Reaxys-RN4188723
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分类

  • {SNA} Building Blocks, C12, Chemical Synthesis, Heterocyclic Building Blocks, Piperazines
  • Building Blocks, C12, Chemical Synthesis, Heterocyclic Building Blocks, Piperazines
  • {KO} Ketones
  • {KO} AminesSecondaryHeteroNH

安全信息

Warnings IRRITANT
WGK Germany3
GHS Symbol
Precautionary statements
  • 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。
  • P305+P351+P338+P337+P313
  • P302+P352+P332+P313+P362+P364
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P305+P351+P338
Signal word
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
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

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 3
Y
Lipinski's Rule of 5
Y
H-bond Donors
1
H-bond Acceptors
3
Rotatable Bonds
3
LogP
6.079000000000000e-001

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. Piperazines 哌嗪
  5. C12 - Piperazines

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