4-(1-Pyrrolidinyl)benzoic Acid 4-(1-吡咯烷基)苯甲酸

CAS 22090-27-3 MFCD01631241

化学结构图

22090-27-3
SMILES: OC(=O)C1C=CC(=CC=1)N1CCCC1

化学属性

Mol. FormulaC11H13NO2
Mol. Weight191
Melting Point296-300

别名和识别编码

Chemical Name4-(1-Pyrrolidinyl)benzoic Acid
CAS Number22090-27-3
Alfabeta NamePYRROLIDINYLBENZENECARBOXYLICACID 41()--
MDL NumberMFCD01631241
Synonym 4-(1-吡咯烷基)苯甲酸
Chemical Name Translation4-(1-吡咯烷基)苯甲酸
PubChem Substance ID329761742
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分类

  • {SNA} Building Blocks, C11 to C12, Chemical Synthesis, Heterocyclic Building Blocks, Pyrrolidines
  • {KO} CarboxylicAcids

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+P351+P338
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
Signal word Warning
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；
Hazard Codes Xi
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 Acceptors
2
Rotatable Bonds
2
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. Pyrrolidines 吡咯烷
  5. C11 to C12 - Pyrrolidines

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