(1-Boc-4-Piperidinylidene)Acetic Acid 1-叔丁氧羰基哌啶-4-亚基乙酸

CAS 193085-24-4 MFCD04115019

化学结构图

193085-24-4
SMILES: CC(C)(C)OC(=O)N1CCC(CC1)=CC(O)=O

化学属性

Mol. FormulaC12H19NO4
Mol. Weight241
Density1.422
Boiling Point
Melting Point

别名和识别编码

Chemical Name(1-Boc-4-Piperidinylidene)Acetic Acid
CAS Number193085-24-4
Alfabeta NameBUTOXYCARBONYLPIPERIDINYLIDENEACETICACID TERT214[]()-----{}
MDL NumberMFCD04115019
Synonym 1-Boc-哌啶-4-亚基乙酸 4-Carboxymethylenepiperidine-1-carboxylic acid tert-butyl ester
Beilstein Registry Number10673080
EC Number250-023-7
Chemical Name Translation1-叔丁氧羰基哌啶-4-亚基乙酸
PubChem Substance ID329764389
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分类

  • Building Blocks, C11 to C12, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis, Organic Building Blocks
  • {KO} CarboxylicAcids
  • {KO} tBocN

安全信息

Warnings IRRITANT
GHS Symbol
WGK Germany3
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。
  • P305 IF IN EYES: 如果进入眼睛
Hazard statements
  • H319 Causes serious eye irritation 严重刺激眼睛
Signal word Warning
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；
  • S36/37/39 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；
Risk Statements
  • R36 Irritating to eyes 刺激眼睛
  • 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
UN Number
RTECS
Packing Group

药物吸收、分布、代谢与排泄(ADME)

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

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. Homopiperidines 同哌啶
  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. Piperidines 哌啶
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Carboxylic Acids - Carbonyl Compounds
  6. C11 to C12 - Carboxylic Acids
  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. Heterocyclic Acids 杂环酸
  5. Piperidine Acids

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