2-(Tert-Butyl)-1H-Indole 2-(叔丁基)-1H-吲哚

CAS 1805-65-8 MFCD04004060

化学结构图

1805-65-8
SMILES: CC(C)(C)c1cc2ccccc2[nH]1

化学属性

Mol. FormulaC12H15N
Mol. Weight173.25
Melting Point75-76 °C
Boiling Point85-95 °C at 0.05 mmHg

别名和识别编码

Chemical Name2-(Tert-Butyl)-1H-Indole
CAS Number1805-65-8
Alfabeta NameBUTYLINDOLE TERTH21()----
MDL NumberMFCD04004060
Synonym 2-tert-Butyl-1H-indole {LY} 2-tert-Butyl-1H-indole {} {LY} 2-tert-Butyl-1H-indole {} {} {LY} 2-tert-Butyl-1H-indole {} {} {} {LY} 2-tert-Butyl-1H-indole {} {} {} {} {LY} 2-tert-Butyl-1H-indole {} {} {} {} {} {LY} 2-tert-Butyl-1H-indole {} {} {} {} {} {} {LY} 2-tert-Butyl-1H-indole {} {} {} {} {} {} {} {LY} 2-tert-Butyl-1H-indole {} {} {} {} {} {} {} {} {LY} 2-tert-Butyl-1H-indole {} {} {} {} {} {} {} {} {} {LY} 2-tert-Butyl-1H-indole {} {} {} {} {} {} {} {} {} {} {LY} 2-tert-Butyl-1H-indole {} {} {} {} {} {} {} {} {} {} {} {LY} 2-tert-Butyl-1H-indole {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-tert-Butyl-1H-indole {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-tert-Butyl-1H-indole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-tert-Butyl-1H-indole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-tert-Butyl-1H-indole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-tert-Butyl-1H-indole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-tert-Butyl
Chemical Name Translation2-(叔丁基)-1H-吲哚
LabNetwork Molecule IDLN00149987
PubChem Substance ID594166
InChIInChI=1S/C12H15N/c1-12(2,3)11-8-9-6-4-5-7-10(9)13-11/h4-8,13H,1-3H3
Canonical SMILESCC(C)(C)C1=CC2=CC=CC=C2N1
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分类

  • {KO} AminesSecondaryHeteroNH

安全信息

Warnings IRRITANT
Hazard Codes Xi
Storage condition 2-8°C, protect from light {LY} 2-8°C, protect from light {} {LY} 2-8°C, protect from light {} {} {LY} 2-8°C, protect from light {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

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
0
Rotatable Bonds
1
LogP
3

其他信息

  • MOL 文件:1805-65-8.mol

系列性分类

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