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Home > Amines > 1190311-61-5

1190311-61-5

1190311-61-5 | 1H-Pyrrolo[3,2-b]pyridine-5-carbonitrile, 3-amino-

CAS No: 1190311-61-5 Catalog No: AG000HIE MDL No:

Product Description

Catalog Number:
AG000HIE
Chemical Name:
1H-Pyrrolo[3,2-b]pyridine-5-carbonitrile, 3-amino-
CAS Number:
1190311-61-5
Molecular Formula:
C8H6N4
Molecular Weight:
158.1600
IUPAC Name:
3-amino-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile
InChI:
InChI=1S/C8H6N4/c9-3-5-1-2-7-8(12-5)6(10)4-11-7/h1-2,4,11H,10H2
InChI Key:
PHRFIOFSGKAARK-UHFFFAOYSA-N
SMILES:
Nc1c[nH]c2c1nc(cc2)C#N

Properties

Complexity:
218  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.059g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
158.164g/mol
Monoisotopic Mass:
158.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
78.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  

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