Home Carboxys 1H-Pyrrolo[2,3-b]pyridine-2-carboxylic acid, 5-amino-

1H-Pyrrolo[2,3-b]pyridine-2-carboxylic acid, 5-amino-

CAS No.:
1260385-74-7
Catalog Number:
AG000QTP
Molecular Formula:
C8H7N3O2
Molecular Weight:
177.1601
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Product Description
Catalog Number:
AG000QTP
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine-2-carboxylic acid, 5-amino-
CAS Number:
1260385-74-7
Molecular Formula:
C8H7N3O2
Molecular Weight:
177.1601
IUPAC Name:
5-amino-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid
InChI:
InChI=1S/C8H7N3O2/c9-5-1-4-2-6(8(12)13)11-7(4)10-3-5/h1-3H,9H2,(H,10,11)(H,12,13)
InChI Key:
VWHLUZNJRYXVRE-UHFFFAOYSA-N
SMILES:
Nc1cnc2c(c1)cc([nH]2)C(=O)O
Properties
Complexity:
221  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.054g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
177.163g/mol
Monoisotopic Mass:
177.054g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
92A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties