3-Benzotriazol-1-yl-propionic Ac… 3-苯并三唑-1-基-丙酸

CAS 654-15-9 MFCD00964153

化学结构图

654-15-9
SMILES: O=C(O)CCn1nnc2ccccc21

化学属性

Mol. FormulaC9H9N3O2
Mol. Weight191.19
Boiling Point433.4±28.0 °C at 760 mmHg

别名和识别编码

Chemical Name3-Benzotriazol-1-yl-propionic Ac…
CAS Number654-15-9
Alfabeta NameBENZOTRIAZOLYLPROPIONICACID 31----
MDL NumberMFCD00964153
Synonym 3-Benzotriazol-1-yl-propionic acid {LY} 3-Benzotriazol-1-yl-propionic acid {} {LY} 3-Benzotriazol-1-yl-propionic acid {} {} {LY} 3-Benzotriazol-1-yl-propionic acid {} {} {} {LY} 3-Benzotriazol-1-yl-propionic acid {} {} {} {} {LY} 3-Benzotriazol-1-yl-propionic acid {} {} {} {} {} {LY} 3-Benzotriazol-1-yl-propionic acid {} {} {} {} {} {} {LY} 3-Benzotriazol-1-yl-propionic acid {} {} {} {} {} {} {} {LY} 3-Benzotriazol-1-yl-propionic acid {} {} {} {} {} {} {} {} {LY} 3-Benzotriazol-1-yl-propionic acid {} {} {} {} {} {} {} {} {} {LY} 3-Benzotriazol-1-yl-propionic acid {} {} {} {} {} {} {} {} {} {} {LY} 3-Benzotriazol-1-yl-propionic acid {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Benzotriazol-1-yl-propionic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Benzotriazol-1-yl-propionic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Benzotriazol-1-yl-propionic acid {} {} {} {} {} {} {} {} {} {} {}
Chemical Name Translation3-苯并三唑-1-基-丙酸
LabNetwork Molecule IDLN00117821
Canonical SMILESC1=CC=C2C(=C1)N=NN2CCC(=O)O
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分类

  • {KO} CarboxylicAcids
  • {SNA} Amines, Aromatic Azides, Azides, Building Blocks, C9, Chemical Synthesis, Nitrogen Compounds, Organic Building Blocks

相关文献及参考

安全信息

Warnings IRRITANT
Hazard Codes Xi Xn
GHS Symbol
WGK Germany3
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
Signal word Danger
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
  • R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
Storage condition

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 5
Y
H-bond Acceptors
4
Rotatable Bonds
3
H-bond Donors
1
LogP
1

其他信息

  • Sigma Aldrich:654-15-9(sigmaaldrich)
  • MOL 文件:654-15-9.mol

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Nitrogen Compounds 氮化合物
  5. Azides - Nitrogen Compounds
  1. C9 - Amines

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