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5192-23-4

5192-23-4 | 4-Aminoindole

CAS No: 5192-23-4 Catalog No: AG003KRE MDL No:MFCD01076559

Product Description

Catalog Number:
AG003KRE
Chemical Name:
4-Aminoindole
CAS Number:
5192-23-4
Molecular Formula:
C8H8N2
Molecular Weight:
132.1625
MDL Number:
MFCD01076559
IUPAC Name:
1H-indol-4-amine
InChI:
InChI=1S/C8H8N2/c9-7-2-1-3-8-6(7)4-5-10-8/h1-5,10H,9H2
InChI Key:
LUNUNJFSHKSXGQ-UHFFFAOYSA-N
SMILES:
Nc1cccc2c1cc[nH]2

Properties

Complexity:
124  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.069g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
132.166g/mol
Monoisotopic Mass:
132.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

Literature

Title Journal
Synthesis and PKCtheta inhibitory activity of a series of 4-indolylamino-5-phenyl-3-pyridinecarbonitriles. Bioorganic & medicinal chemistry letters 20090501
Prediction of genotoxicity of chemical compounds by statistical learning methods. Chemical research in toxicology 20050601

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