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1260386-70-6 | 1H-Pyrrolo[3,2-b]pyridine-2-carboxylic acid, 6-amino-
CAS No: 1260386-70-6 Catalog No: AG000QTG MDL No:
Product Description
Catalog Number:
AG000QTG
Chemical Name:
1H-Pyrrolo[3,2-b]pyridine-2-carboxylic acid, 6-amino-
CAS Number:
1260386-70-6
Molecular Formula:
C8H7N3O2
Molecular Weight:
177.1601
IUPAC Name:
6-amino-1H-pyrrolo[3,2-b]pyridine-2-carboxylic acid
InChI:
InChI=1S/C8H7N3O2/c9-4-1-6-5(10-3-4)2-7(11-6)8(12)13/h1-3,11H,9H2,(H,12,13)
InChI Key:
PPJWWYIASTXSNX-UHFFFAOYSA-N
SMILES:
Nc1cnc2c(c1)[nH]c(c2)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:
0.2
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